data_2mze_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 2mze _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 21.1 t-105 . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.747 0.308 . . . . 71.22 110.898 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 49.7 tt0 -73.3 -35.46 66.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.267 -0.424 . . . . 72.51 110.852 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 13.3 mt-30 -62.92 -36.83 84.67 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.206 -0.452 . . . . 74.32 110.903 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.1 -35.16 69.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.202 -0.454 . . . . 74.22 111.117 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.78 -42.91 94.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.149 -0.478 . . . . 73.12 110.912 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -76.99 -31.48 56.53 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.19 -0.459 . . . . 72.4 110.87 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -60.33 -44.08 95.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.159 -0.473 . . . . 75.11 110.907 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -71.43 -22.27 61.87 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.138 -0.483 . . . . 75.43 110.862 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.441 ' HE2' ' HA ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -72.3 -43.75 63.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.2 -0.455 . . . . 75.45 110.919 179.816 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.441 ' HA ' ' HE2' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -70.25 -27.84 64.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.445 . . . . 74.22 110.853 179.999 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -74.09 -5.72 43.33 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.21 -0.45 . . . . 75.2 110.852 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.163 -0.471 . . . . 74.4 110.943 -179.907 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.3 tt . . . . . 0 N--CA 1.458 -0.048 0 CA-C-O 120.76 0.314 . . . . 74.54 110.913 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.93 -51.12 65.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.136 -0.484 . . . . 73.13 110.857 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.31 -50.48 69.9 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.177 -0.465 . . . . 71.12 111.097 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.462 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 24.4 mmmt -59.95 -49.51 77.39 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.226 -0.443 . . . . 74.43 110.896 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.412 ' O ' ' HG2' ' A' ' 43' ' ' GLN . 0.1 OUTLIER -56.67 -36.99 70.21 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.266 -0.425 . . . . 74.44 110.894 179.917 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.5 ttmt -58.99 -45.5 90.48 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.451 . . . . 74.2 110.856 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.462 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 2.9 pt-20 -60.58 -32.84 71.92 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.247 -0.433 . . . . 75.11 110.827 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 7.2 ttt -68.47 -34.0 75.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.171 -0.468 . . . . 63.43 110.876 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.466 ' HG3' ' HA ' ' A' ' 51' ' ' THR . 2.3 mm100 -60.65 -39.98 90.33 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.215 -0.448 . . . . 75.32 110.916 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.2 mmpt? -70.58 -33.13 70.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 75.11 110.9 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 38.4 t80 -70.77 -37.33 73.36 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.232 -0.44 . . . . 73.32 110.903 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -81.91 -35.63 28.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.108 -0.496 . . . . 70.43 110.869 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . 0.423 ' HA2' ' HB3' ' A' ' 206' ' ' SER . . . 102.98 -10.2 55.41 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.742 -0.742 . . . . 64.42 112.51 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.84 139.76 95.55 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.644 0.735 . . . . 74.31 110.898 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.77 -53.23 0.28 Allowed 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.68 2.253 . . . . 74.5 112.318 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -50.64 108.27 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.209 -0.451 . . . . 72.24 111.129 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.466 ' HA ' ' HG3' ' A' ' 43' ' ' GLN . 1.2 p -96.81 155.56 16.72 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.199 -0.455 . . . . 73.25 111.138 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 57.68 20.63 40.13 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.736 -0.745 . . . . 64.24 112.49 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.0 mtt -99.81 158.91 15.46 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.759 0.314 . . . . 75.23 110.917 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 23.4 tp -174.63 78.54 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.287 -0.415 . . . . 74.32 110.928 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 178.8 -31.22 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.242 -0.435 . . . . 61.31 110.905 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 8.5 m -91.14 -99.81 0.11 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.159 -0.473 . . . . 75.25 110.867 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 42.6 ttt85 -84.96 -29.36 25.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.11 -0.496 . . . . 74.13 110.857 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 93.1 t -64.23 -41.61 92.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.208 -0.451 . . . . 72.2 111.117 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -75.09 -31.72 25.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.192 -0.458 . . . . 75.2 111.11 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -63.58 -44.39 94.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.186 -0.461 . . . . 73.45 110.863 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 24.3 pt -67.32 -30.1 47.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 74.52 111.132 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 1.5 mmm -66.03 -36.22 82.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.159 -0.473 . . . . 74.01 110.931 179.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -87.74 -22.74 24.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 45.15 110.916 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 34.7 mttp -80.4 145.11 58.8 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.561 0.696 . . . . 75.32 110.888 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.81 161.08 47.31 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.689 2.259 . . . . 72.11 112.358 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 29.0 ttp180 -161.65 -82.5 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.195 -0.457 . . . . 73.22 110.903 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -145.36 156.45 43.79 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.175 -0.466 . . . . 72.31 110.878 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.548 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -96.79 14.23 64.28 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.721 -0.752 . . . . 64.23 112.452 -179.862 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -111.22 142.09 25.68 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.636 0.731 . . . . 74.23 111.098 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.82 178.21 4.84 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.65 2.234 . . . . 63.44 112.367 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -107.97 -2.9 19.31 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.25 -0.432 . . . . 74.45 110.841 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.224 -0.443 . . . . 73.52 111.166 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 C--O 1.232 0.182 0 CA-C-O 120.836 0.265 . . . . 72.25 112.309 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 8.5 mttp -83.31 168.43 16.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.252 -0.431 . . . . 72.53 110.913 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . 0.5 ' CD1' ' HA ' ' A' ' 200' ' ' LEU . 35.4 m95 -53.55 131.78 39.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.248 -0.433 . . . . 73.31 110.957 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.23 1.03 13.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.272 -0.422 . . . . 71.34 111.154 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.2 m -73.39 178.28 4.68 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.237 -0.438 . . . . 73.12 110.843 -179.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.81 -10.22 22.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.135 -0.484 . . . . 71.12 110.882 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -156.18 142.85 10.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.221 -0.445 . . . . 74.14 111.073 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 76.8 t -116.65 130.33 71.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.15 -0.477 . . . . 72.25 111.081 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -118.45 144.57 45.89 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.115 -0.493 . . . . 75.51 111.124 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 4.6 p90 -137.62 146.38 43.87 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.202 -0.454 . . . . 70.51 110.937 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 6.1 ttt180 -149.4 131.68 15.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.113 -0.494 . . . . 74.3 110.833 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.463 HD11 ' HA ' ' A' ' 106' ' ' ASP . 4.8 mp -75.18 132.52 33.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.191 -0.459 . . . . 72.4 111.13 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 21.6 t -86.25 -40.25 14.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.163 -0.471 . . . . 74.41 111.112 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 92.0 p -156.42 169.34 24.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.172 -0.467 . . . . 64.24 110.818 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 11.5 p90 -125.39 154.98 41.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.126 -0.488 . . . . 74.1 110.911 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.9 t -96.59 141.14 30.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.159 -0.473 . . . . 75.33 111.097 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 2.6 mmp_? -53.06 -18.22 1.97 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 72.14 110.827 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.94 -35.92 82.71 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.196 -0.456 . . . . 74.13 110.894 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -141.86 153.7 64.65 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.602 0.715 . . . . 72.52 110.89 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . 0.421 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.6 Cg_endo -69.77 151.02 68.88 Favored 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.692 2.262 . . . . 73.11 112.356 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 11.8 t-160 -52.36 -27.6 16.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.229 -0.441 . . . . 74.11 110.833 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.421 HG22 ' HB2' ' A' ' 101' ' ' PRO . 0.0 OUTLIER -75.37 -40.5 42.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.232 -0.44 . . . . 74.02 111.141 179.991 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 3.6 m -69.83 -38.42 76.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.138 -0.483 . . . . 54.24 111.184 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 81.3 t -72.81 -45.55 56.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.173 -0.467 . . . . 73.13 111.134 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.625 ' O ' HG23 ' A' ' 109' ' ' VAL . 2.6 t0 -63.41 -42.6 98.77 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.183 -0.462 . . . . 63.44 110.829 179.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 11.2 ptm180 -70.11 -34.15 72.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.462 . . . . 75.02 110.87 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.567 ' HB3' ' HD2' ' A' ' 188' ' ' PHE . 0.0 OUTLIER -62.08 -48.73 78.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.217 -0.447 . . . . 75.05 110.914 -179.969 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.625 HG23 ' O ' ' A' ' 106' ' ' ASP . 1.5 m -55.4 -42.12 65.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.454 . . . . 72.31 111.114 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.469 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 48.0 t -70.22 -33.36 71.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.223 -0.444 . . . . 72.14 110.894 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.84 -32.82 73.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.15 -0.477 . . . . 74.35 110.876 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -97.48 -40.31 8.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.198 -0.456 . . . . 74.32 111.059 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.26 -33.58 76.33 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.243 -0.435 . . . . 74.11 110.88 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 46.6 t30 -69.74 -40.55 76.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 75.15 110.9 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.86 -34.56 71.75 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.206 -0.452 . . . . 74.0 110.868 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 7.8 m95 -66.45 -41.33 89.25 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.211 -0.45 . . . . 75.23 110.915 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -72.72 -38.85 56.66 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.761 -0.733 . . . . 73.44 112.471 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.0 mmpt? -62.66 -16.3 56.28 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.758 0.313 . . . . 74.42 110.921 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 37.2 mm-40 -100.4 13.33 34.83 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.222 -0.444 . . . . 75.55 110.892 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . 0.405 HG13 ' HB2' ' A' ' 122' ' ' LEU . 6.4 pt -148.09 152.62 40.22 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.601 0.715 . . . . 71.34 111.136 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.74 1.21 4.63 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.685 2.257 . . . . 75.35 112.325 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.407 ' HB3' ' H ' ' A' ' 123' ' ' HIS . 4.3 mt -62.63 -156.61 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.228 -0.442 . . . . 73.22 110.936 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . 0.407 ' H ' ' HB3' ' A' ' 122' ' ' LEU . 5.7 t60 -160.56 142.61 12.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.151 -0.477 . . . . 74.12 110.837 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 28.5 m-85 -121.59 148.52 44.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.182 -0.463 . . . . 75.54 110.849 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -126.97 141.69 51.73 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.136 -0.484 . . . . 75.14 110.93 -179.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.63 148.61 30.18 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.235 -0.439 . . . . 74.04 110.937 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 25.6 m -103.14 126.31 57.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.278 -0.419 . . . . 50.13 111.087 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -144.34 -11.11 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.163 -0.471 . . . . 74.43 111.081 179.945 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -157.44 109.17 2.35 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.193 -0.458 . . . . 73.32 110.949 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 109.77 -162.65 12.62 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.758 -0.734 . . . . 62.11 112.485 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 9.7 p -101.96 156.06 17.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.759 0.314 . . . . 71.11 111.13 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -111.77 165.39 12.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.186 -0.461 . . . . 72.32 111.098 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -71.88 -55.13 8.07 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.22 -0.445 . . . . 75.41 110.825 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 5.0 mp -95.37 108.8 21.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.251 -0.432 . . . . 71.04 111.114 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 14.2 mmm -90.76 127.75 36.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.189 -0.459 . . . . 72.43 110.941 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -106.24 95.14 3.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.263 -0.426 . . . . 70.04 111.147 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -132.06 163.52 23.88 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.753 -0.737 . . . . 63.34 112.517 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 49.9 m-85 -105.22 150.03 25.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.864 0.364 . . . . 74.01 110.885 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . 174.45 166.89 0.24 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.107 -0.497 . . . . 71.21 111.122 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 29.4 mtm180 -104.41 173.2 6.4 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.211 -0.45 . . . . 72.34 110.865 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -57.28 -15.91 17.82 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.758 -0.734 . . . . 74.24 112.464 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -96.51 13.3 28.49 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.756 0.312 . . . . 75.03 111.039 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 4.1 p80 -75.81 -5.15 44.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.245 -0.434 . . . . 73.45 110.862 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 121.37 20.41 3.28 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.741 -0.742 . . . . 60.43 112.498 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -124.76 173.31 8.66 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.843 0.354 . . . . 72.14 110.864 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 20.5 m -75.42 170.51 15.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.196 -0.456 . . . . 64.54 110.846 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 64.89 132.57 0.03 OUTLIER Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.703 0.763 . . . . 73.4 110.928 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 152.01 69.11 Favored 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.708 2.272 . . . . 74.53 112.372 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 149' ' ' PHE . . . . . 0.492 ' C ' ' H ' ' A' ' 151' ' ' GLY . 21.3 p90 -53.01 -41.4 64.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.243 -0.435 . . . . 70.0 110.877 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 76.19 -25.13 0.21 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.171 -0.468 . . . . 72.24 110.902 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . 0.492 ' H ' ' C ' ' A' ' 149' ' ' PHE . . . 77.07 -151.35 38.68 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.74 -0.743 . . . . 75.42 112.481 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.75 142.15 47.18 Favored 'Trans proline' 0 C--N 1.341 0.137 0 C-N-CA 122.704 2.269 . . . . 75.11 112.333 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . 0.434 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 104.15 -137.19 13.43 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.725 -0.75 . . . . 70.32 112.418 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 154' ' ' ASN . . . . . 0.434 ' C ' ' O ' ' A' ' 153' ' ' GLY . 4.1 p30 -34.53 138.09 0.11 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.955 0.407 . . . . 74.45 110.886 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 1.5 m 73.29 112.23 0.06 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.166 -0.47 . . . . 63.14 111.171 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 156' ' ' LEU . . . . . 0.456 HD13 HG13 ' A' ' 186' ' ' ILE . 0.6 OUTLIER -94.92 -53.09 3.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.244 -0.434 . . . . 75.02 110.918 179.975 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . 0.548 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -163.85 148.58 10.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.201 -0.454 . . . . 73.44 111.107 179.773 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 16.1 p-80 -106.8 124.37 49.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 74.34 110.917 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -110.48 152.39 26.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.254 -0.43 . . . . 74.42 111.108 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -105.46 151.86 23.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.231 -0.44 . . . . 75.31 110.876 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -82.79 164.06 48.56 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.581 0.705 . . . . 71.14 111.111 179.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.79 79.17 0.97 Allowed 'Trans proline' 0 C--N 1.34 0.127 0 C-N-CA 122.661 2.241 . . . . 74.44 112.347 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -137.98 124.71 3.03 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.73 -0.748 . . . . 72.32 112.497 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 63.31 -171.1 0.17 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.797 0.332 . . . . 73.1 111.135 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -86.0 -41.32 7.17 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.74 -0.743 . . . . 74.03 112.465 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 10.2 tt -71.32 -37.21 71.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.837 0.351 . . . . 75.02 110.913 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -79.11 161.24 47.12 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.766 -0.731 . . . . 43.43 112.488 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 91.29 23.08 30.24 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.765 -0.731 . . . . 74.31 112.54 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -94.42 167.03 11.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.848 0.356 . . . . 63.41 110.878 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.46 130.69 55.9 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.207 -0.451 . . . . 74.21 111.105 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 24.6 m170 -126.29 158.6 35.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.225 -0.443 . . . . 72.53 110.881 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -142.99 138.83 30.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.208 -0.451 . . . . 71.44 110.85 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 59.2 t0 -69.21 97.8 0.96 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.138 -0.483 . . . . 74.11 110.887 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.41 -17.04 10.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.228 -0.442 . . . . 74.45 110.844 -179.869 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -78.97 -16.12 57.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.464 . . . . 73.32 110.824 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -80.13 -174.96 4.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.229 -0.441 . . . . 71.41 110.911 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 24.7 mtm-85 -109.41 107.23 17.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 74.32 110.877 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 68.2 m95 -108.56 137.17 46.94 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.219 -0.446 . . . . 74.32 110.945 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 11.1 t -178.33 163.59 1.63 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.266 -0.425 . . . . 74.13 111.14 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -125.54 -72.59 0.66 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.18 -0.464 . . . . 61.52 110.871 179.89 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -60.25 -16.16 40.83 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.702 -0.761 . . . . 62.41 112.514 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 182' ' ' SER . . . . . 0.432 ' O ' ' C ' ' A' ' 183' ' ' SER . 0.3 OUTLIER -90.62 -24.38 20.54 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.909 0.385 . . . . 74.0 110.933 -179.781 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 183' ' ' SER . . . . . 0.432 ' C ' ' O ' ' A' ' 182' ' ' SER . 91.0 p 35.61 58.17 0.87 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.087 -0.506 . . . . 64.12 110.866 -179.847 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 9.1 tt -116.75 -33.5 4.79 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.09 -0.505 . . . . 74.43 110.91 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -119.38 -139.29 5.94 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.752 -0.737 . . . . 74.22 112.488 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 186' ' ' ILE . . . . . 0.456 HG13 HD13 ' A' ' 156' ' ' LEU . 8.5 mm -79.54 100.32 4.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.882 0.372 . . . . 73.22 111.162 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -48.96 119.13 2.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.136 -0.484 . . . . 71.31 110.888 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 188' ' ' PHE . . . . . 0.567 ' HD2' ' HB3' ' A' ' 108' ' ' LEU . 1.2 t80 -53.72 -34.36 58.6 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.172 -0.467 . . . . 75.45 110.891 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . 0.413 HD21 HD11 ' A' ' 108' ' ' LEU . 0.2 OUTLIER -67.16 -48.18 68.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.15 -0.477 . . . . 60.14 110.939 -179.991 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -70.12 -37.75 75.41 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.204 -0.453 . . . . 74.22 110.912 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -72.63 -35.47 67.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.104 -0.498 . . . . 61.32 111.138 179.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 192' ' ' ALA . . . . . 0.48 ' O ' ' HB2' ' A' ' 196' ' ' LEU . . . -60.79 -45.09 95.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.193 -0.458 . . . . 52.32 111.121 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 11.1 m -58.76 -44.99 90.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.17 -0.468 . . . . 72.43 111.12 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 6.8 t60 -73.04 -39.79 65.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.216 -0.447 . . . . 71.44 110.857 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -71.76 -48.13 48.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.178 -0.464 . . . . 71.01 111.102 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 196' ' ' LEU . . . . . 0.483 ' N ' HD23 ' A' ' 196' ' ' LEU . 4.5 mm? -62.11 -37.01 83.46 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.243 -0.435 . . . . 74.52 110.917 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -60.74 -27.69 66.91 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.762 -0.733 . . . . 62.43 112.512 179.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 198' ' ' HIS . . . . . . . . . . . . . 6.5 m-70 -67.31 -35.07 78.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.752 0.31 . . . . 75.21 110.806 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -68.73 -21.46 64.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.214 -0.448 . . . . 73.13 110.855 -179.774 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 200' ' ' LEU . . . . . 0.5 ' HA ' ' CD1' ' A' ' 84' ' ' TRP . 0.5 OUTLIER -88.53 2.11 53.57 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.12 -0.491 . . . . 75.12 110.91 -179.992 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 84.04 -7.67 70.03 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.731 -0.747 . . . . 50.41 112.474 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 202' ' ' MET . . . . . . . . . . . . . 98.7 mmm -53.92 167.47 0.27 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.781 0.324 . . . . 71.04 110.868 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -137.1 161.4 25.18 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.719 -0.753 . . . . 64.44 112.512 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 13.2 m-70 -57.43 143.85 38.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.824 0.345 . . . . 74.32 110.835 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -105.92 152.52 23.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 72.42 110.897 -179.835 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 206' ' ' SER . . . . . 0.423 ' HB3' ' HA2' ' A' ' 47' ' ' GLY . 1.1 m -88.07 -4.77 58.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.156 -0.474 . . . . 72.22 110.853 -179.802 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.55 138.98 83.52 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-O 121.603 0.716 . . . . 65.11 110.865 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 -7.92 22.29 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.684 2.256 . . . . 74.53 112.36 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 -125.72 28.91 6.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.234 -0.439 . . . . 63.52 110.915 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 210' ' ' ALA . . . . . 0.416 ' O ' ' HB2' ' A' ' 213' ' ' TYR . . . -87.11 145.61 26.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.151 -0.477 . . . . 64.4 111.09 179.879 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -73.24 -26.05 22.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.459 . . . . 75.23 111.158 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 11.3 mmm -93.78 10.07 34.56 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.138 -0.483 . . . . 75.22 110.884 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 213' ' ' TYR . . . . . 0.425 ' CD1' ' HD2' ' A' ' 214' ' ' PRO . 0.5 OUTLIER -55.54 127.54 66.45 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.669 0.747 . . . . 73.43 110.918 -179.865 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 214' ' ' PRO . . . . . 0.425 ' HD2' ' CD1' ' A' ' 213' ' ' TYR . 54.0 Cg_endo -69.75 -18.47 37.03 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.634 2.222 . . . . 63.01 112.379 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 1.2 p -90.16 32.16 0.95 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.197 -0.456 . . . . 74.24 111.129 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 6.5 t80 . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.175 -0.466 . . . . 74.42 110.929 -179.928 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.074 0 CA-C-O 120.962 0.41 . . . . 71.11 110.871 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.98 -164.68 1.94 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.123 -0.49 . . . . 65.02 110.883 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -59.28 148.77 30.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.255 -0.43 . . . . 62.53 110.863 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 227' ' ' SER . . . . . 0.407 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 10.5 t -86.93 163.43 17.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.184 -0.462 . . . . 74.21 110.841 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -64.88 -62.28 1.66 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.092 -0.504 . . . . 74.54 110.889 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -55.57 -28.47 55.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.179 -0.464 . . . . 74.2 110.833 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -69.22 -48.61 61.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.181 -0.463 . . . . 74.23 110.892 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 231' ' ' ILE . . . . . . . . . . . . . 7.9 mt -68.86 -41.73 82.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.165 -0.471 . . . . 73.41 111.123 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 33.7 pttt -65.65 -32.58 74.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.193 -0.458 . . . . 73.32 110.873 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -64.88 -47.22 85.34 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.773 -0.727 . . . . 65.45 112.466 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 8.5 tt -72.55 -30.32 33.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.792 0.329 . . . . 74.41 111.123 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -68.73 -23.81 64.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.181 -0.463 . . . . 71.13 110.896 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 236' ' ' LYS . . . . . 0.475 ' HD3' ' N ' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.31 -27.98 60.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.168 -0.469 . . . . 74.41 110.909 179.975 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 237' ' ' LEU . . . . . 0.475 ' N ' ' HD3' ' A' ' 236' ' ' LYS . 9.9 tt -95.77 -31.25 13.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.199 -0.455 . . . . 75.41 110.901 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 238' ' ' TYR . . . . . . . . . . . . . 30.7 m-85 -92.02 -35.03 14.18 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.199 -0.455 . . . . 54.42 110.953 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.333 0 C-N-CA 120.781 -0.724 . . . . 72.22 112.506 179.943 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 16.2 t-105 . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.747 0.308 . . . . 71.22 110.898 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -67.16 -35.59 80.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.2 -0.454 . . . . 72.51 110.853 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.51 -37.61 88.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.183 -0.462 . . . . 74.32 110.908 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.1 -37.25 86.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.23 -0.441 . . . . 74.22 111.106 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -65.36 -42.85 92.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.219 -0.446 . . . . 73.12 110.85 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -76.55 -31.65 57.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.289 -0.414 . . . . 72.4 110.855 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -60.36 -43.65 96.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.213 -0.449 . . . . 75.11 110.934 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -71.4 -21.24 62.02 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.15 -0.477 . . . . 75.43 110.93 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -71.55 -48.24 49.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.221 -0.445 . . . . 75.45 110.852 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.83 -28.53 69.92 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.258 -0.428 . . . . 74.22 110.883 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -62.59 -25.26 67.99 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.18 -0.464 . . . . 75.2 110.861 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.125 -0.489 . . . . 74.4 110.937 -179.842 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.231 0.081 0 CA-C-O 120.771 0.319 . . . . 74.54 110.903 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.1 -51.67 62.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.26 -0.427 . . . . 73.13 110.841 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.74 -44.13 86.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.47 . . . . 71.12 111.165 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.99 -38.3 82.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.208 -0.451 . . . . 74.43 110.844 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.6 mp -67.45 -35.49 79.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.232 -0.44 . . . . 74.44 110.956 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.46 -45.93 87.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 74.2 110.899 179.863 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.545 ' HG3' ' N ' ' A' ' 42' ' ' MET . 0.0 OUTLIER -60.34 -31.92 70.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 75.11 110.943 179.902 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.545 ' N ' ' HG3' ' A' ' 41' ' ' GLU . 1.4 ttt -68.27 -34.23 75.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.098 -0.501 . . . . 63.43 110.904 179.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.417 ' HG3' ' HA ' ' A' ' 51' ' ' THR . 1.5 mm-40 -62.22 -39.48 92.95 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.242 -0.435 . . . . 75.32 110.911 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.1 mmpt? -68.59 -27.33 65.96 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.209 -0.45 . . . . 75.11 110.908 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 34.4 t80 -69.79 -45.63 67.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.225 -0.443 . . . . 73.32 110.898 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 -82.83 -34.52 26.86 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.096 -0.502 . . . . 70.43 110.907 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 100.13 -3.05 56.77 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.719 -0.753 . . . . 64.42 112.486 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.86 142.17 88.79 Favored Pre-proline 0 C--N 1.328 -0.356 0 CA-C-O 121.616 0.722 . . . . 74.31 110.856 -179.847 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.77 -52.55 0.32 Allowed 'Trans proline' 0 C--N 1.342 0.219 0 C-N-CA 122.706 2.271 . . . . 74.5 112.314 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -52.67 108.24 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.262 -0.427 . . . . 72.24 111.128 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.417 ' HA ' ' HG3' ' A' ' 43' ' ' GLN . 1.5 t -108.58 158.5 17.51 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.214 -0.448 . . . . 73.25 111.153 179.93 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 58.61 18.06 36.41 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.722 -0.752 . . . . 64.24 112.545 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 1.9 mmm -118.95 161.14 20.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.799 0.333 . . . . 75.23 110.902 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 53.2 tp -157.64 83.87 0.89 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.273 -0.421 . . . . 74.32 110.961 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -179.59 -31.9 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.173 -0.467 . . . . 61.31 110.859 179.951 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 28.9 t -80.12 -101.3 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.211 -0.449 . . . . 75.25 110.832 -179.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -84.89 -28.15 26.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 74.13 110.924 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.461 ' O ' HG13 ' A' ' 61' ' ' ILE . 90.5 t -59.52 -43.35 90.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.188 -0.46 . . . . 72.2 111.066 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 3.9 mm -75.13 -31.36 24.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.199 -0.455 . . . . 75.2 111.105 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -59.56 -44.08 93.38 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 73.45 110.923 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.461 HG13 ' O ' ' A' ' 58' ' ' VAL . 1.6 pp -74.57 -29.25 23.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.18 -0.464 . . . . 74.52 111.157 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -57.95 -41.25 82.42 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.194 -0.457 . . . . 74.01 110.903 179.794 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -89.33 -24.47 21.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.26 -0.427 . . . . 45.15 110.888 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 10.2 mttm -85.22 120.05 72.99 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.594 0.711 . . . . 75.32 110.894 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.73 151.63 69.25 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.686 2.258 . . . . 72.11 112.36 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.76 -64.2 0.22 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.176 -0.465 . . . . 73.22 110.825 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 13.9 p -145.04 149.6 35.39 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.237 -0.438 . . . . 72.31 110.885 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.582 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -104.72 18.26 44.21 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.733 -0.746 . . . . 64.23 112.456 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -96.16 135.54 22.6 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.576 0.703 . . . . 74.23 111.175 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -69.87 143.06 49.1 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.677 2.251 . . . . 63.44 112.268 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -100.2 26.49 6.46 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.164 -0.471 . . . . 74.45 110.858 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 116.176 -0.466 . . . . 73.52 111.152 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.498 ' HG2' ' H ' ' A' ' 83' ' ' LYS . 53.8 Cg_endo . . . . . 0 C--O 1.231 0.145 0 CA-C-O 120.835 0.265 . . . . 72.25 112.368 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.498 ' H ' ' HG2' ' A' ' 82' ' ' PRO . 4.4 mttp -45.13 141.86 2.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.199 -0.455 . . . . 72.53 110.914 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . 0.431 ' CE2' HD22 ' A' ' 200' ' ' LEU . 40.5 m0 -47.05 109.87 0.24 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.223 -0.444 . . . . 73.31 110.907 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -114.09 -6.98 13.09 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.288 -0.414 . . . . 71.34 111.146 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -58.18 168.64 0.99 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.209 -0.45 . . . . 73.12 110.883 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 18.7 mttp -73.96 -30.55 62.59 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.095 -0.502 . . . . 71.12 110.942 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -159.84 144.93 6.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.215 -0.448 . . . . 74.14 111.17 179.841 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 13.0 t -126.2 140.96 47.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.194 -0.457 . . . . 72.25 111.082 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 76.8 p -122.38 166.52 14.58 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.172 -0.467 . . . . 75.51 111.17 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 3.9 p90 -151.42 146.29 25.85 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.261 -0.427 . . . . 70.51 110.915 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 17.2 ttt180 -146.33 137.42 24.4 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.139 -0.482 . . . . 74.3 110.952 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.438 HD12 ' HA ' ' A' ' 106' ' ' ASP . 3.5 mp -75.0 135.44 27.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.182 -0.463 . . . . 72.4 111.144 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.445 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 21.8 t -89.25 -40.63 13.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.225 -0.443 . . . . 74.41 111.114 179.846 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 1.7 t -143.74 161.83 37.59 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.197 -0.456 . . . . 64.24 110.861 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 11.8 p90 -110.19 153.25 25.03 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.129 -0.487 . . . . 74.1 110.901 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' THR . . . . . 0.437 ' O ' ' O ' ' A' ' 100' ' ' LEU . 0.2 OUTLIER -82.61 140.94 32.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.139 -0.482 . . . . 75.33 111.112 -179.966 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 6.5 ppt_? -73.67 -7.66 52.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.276 -0.42 . . . . 72.14 110.863 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -96.57 -25.98 15.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.194 -0.457 . . . . 74.13 110.869 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.437 ' O ' ' O ' ' A' ' 97' ' ' THR . 0.6 OUTLIER -133.64 153.73 80.32 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.599 0.714 . . . . 72.52 110.914 -179.959 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . 0.421 ' HB2' HG21 ' A' ' 103' ' ' ILE . 53.9 Cg_endo -69.69 150.91 69.24 Favored 'Trans proline' 0 C--O 1.231 0.151 0 C-N-CA 122.723 2.282 . . . . 73.11 112.318 179.902 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 16.3 t-160 -53.35 -25.57 15.73 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.233 -0.44 . . . . 74.11 110.83 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.421 HG21 ' HB2' ' A' ' 101' ' ' PRO . 13.2 tt -76.58 -38.74 31.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.231 -0.441 . . . . 74.02 111.134 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 3.1 m -69.21 -39.94 78.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.197 -0.456 . . . . 54.24 111.197 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 91.6 t -72.7 -45.95 55.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 73.13 111.169 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.608 ' O ' HG23 ' A' ' 109' ' ' VAL . 4.8 t0 -63.41 -43.33 97.81 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.108 -0.496 . . . . 63.44 110.831 179.939 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -70.16 -33.63 72.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.139 -0.482 . . . . 75.02 110.825 -179.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.57 ' HB3' ' HD2' ' A' ' 188' ' ' PHE . 0.0 OUTLIER -60.7 -48.72 80.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.216 -0.447 . . . . 75.05 110.937 -179.989 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.608 HG23 ' O ' ' A' ' 106' ' ' ASP . 1.5 m -55.28 -41.58 62.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.263 -0.426 . . . . 72.31 111.132 179.836 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.461 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 42.9 t -70.13 -33.43 71.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 72.14 110.906 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -61.93 -32.92 73.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.081 -0.509 . . . . 74.35 110.875 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.69 -40.91 8.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.239 -0.437 . . . . 74.32 111.13 179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.69 -34.12 77.46 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.199 -0.455 . . . . 74.11 110.971 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -69.36 -35.11 75.53 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.199 -0.455 . . . . 75.15 110.904 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.07 -34.98 78.84 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.181 -0.463 . . . . 74.0 110.963 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 6.8 m95 -64.47 -49.18 72.41 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.216 -0.447 . . . . 75.23 110.92 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' GLY . . . . . 0.407 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -71.84 -29.86 66.7 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.703 -0.761 . . . . 73.44 112.479 -179.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.2 mtmt -61.36 -17.71 55.24 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.817 0.342 . . . . 74.42 110.923 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -97.96 13.26 31.4 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.124 -0.489 . . . . 75.55 110.901 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . 0.529 ' C ' ' H ' ' A' ' 122' ' ' LEU . 3.3 pt -148.28 144.96 19.37 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.631 0.729 . . . . 71.34 111.096 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.69 28.17 0.18 Allowed 'Trans proline' 0 C--O 1.232 0.206 0 C-N-CA 122.72 2.28 . . . . 75.35 112.316 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.529 ' H ' ' C ' ' A' ' 120' ' ' ILE . 10.3 mt -76.83 -160.25 0.15 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.275 -0.42 . . . . 73.22 110.911 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . 0.414 ' H ' ' HB3' ' A' ' 122' ' ' LEU . 3.4 t-160 -153.49 120.95 5.88 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.165 -0.47 . . . . 74.12 110.831 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 9.3 m-30 -110.31 142.74 41.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.189 -0.46 . . . . 75.54 110.838 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -123.84 141.23 52.22 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.123 -0.49 . . . . 75.14 110.857 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.14 157.79 25.19 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.188 -0.46 . . . . 74.04 110.894 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 25.2 m -103.15 126.32 57.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.208 -0.451 . . . . 50.13 111.149 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -145.82 -10.77 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.227 -0.442 . . . . 74.43 111.164 179.878 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -156.57 109.18 2.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.177 -0.465 . . . . 73.32 110.888 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 105.28 -163.34 14.24 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.754 -0.736 . . . . 62.11 112.471 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -101.88 156.42 17.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.792 0.329 . . . . 71.11 111.101 -179.836 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -111.41 165.27 12.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.16 -0.473 . . . . 72.32 111.127 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -76.74 -53.69 7.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.269 -0.423 . . . . 75.41 110.918 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . 0.441 ' CD1' ' N ' ' A' ' 134' ' ' ILE . 1.9 mp -89.92 107.76 18.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.21 -0.45 . . . . 71.04 111.085 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' MET . . . . . 0.445 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 22.0 mmm -95.79 130.94 42.57 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.15 -0.477 . . . . 72.43 110.878 179.814 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -111.22 90.29 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.186 -0.461 . . . . 70.04 111.113 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -130.02 167.46 21.72 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.769 -0.729 . . . . 63.34 112.522 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 46.8 m-85 -105.49 150.88 24.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.9 0.381 . . . . 74.01 110.908 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . 177.01 167.42 0.54 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.179 -0.464 . . . . 71.21 111.13 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 6.7 mtp180 -103.94 173.09 6.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.172 -0.467 . . . . 72.34 110.913 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -57.91 -15.55 20.89 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.73 -0.747 . . . . 74.24 112.506 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -98.74 13.32 32.68 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.831 0.348 . . . . 75.03 111.104 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 6.2 p80 -71.48 -9.36 58.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.242 -0.435 . . . . 73.45 110.871 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 118.99 49.84 0.32 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.748 -0.739 . . . . 60.43 112.461 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -170.23 -176.78 2.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.767 0.318 . . . . 72.14 110.877 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -76.19 -179.74 5.21 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.259 -0.428 . . . . 64.54 110.903 -179.787 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 147' ' ' TYR . . . . . 0.403 ' HA ' ' HD2' ' A' ' 148' ' ' PRO . 0.2 OUTLIER 65.01 107.31 0.03 OUTLIER Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 121.656 0.741 . . . . 73.4 110.863 -179.922 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 148' ' ' PRO . . . . . 0.403 ' HD2' ' HA ' ' A' ' 147' ' ' TYR . 53.8 Cg_endo -69.76 151.9 69.19 Favored 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.689 2.259 . . . . 74.53 112.334 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 149' ' ' PHE . . . . . 0.419 ' O ' ' CG ' ' A' ' 150' ' ' ASP . 0.4 OUTLIER -53.43 -25.51 16.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.242 -0.435 . . . . 70.0 110.89 179.98 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . 0.419 ' CG ' ' O ' ' A' ' 149' ' ' PHE . 2.0 p30 45.38 24.44 0.16 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.151 -0.477 . . . . 72.24 110.821 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 42.62 -160.52 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.743 -0.741 . . . . 75.42 112.511 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 144.55 54.38 Favored 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.701 2.267 . . . . 75.11 112.312 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . 0.457 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 105.97 -133.87 11.82 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.673 -0.775 . . . . 70.32 112.471 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 154' ' ' ASN . . . . . 0.457 ' C ' ' O ' ' A' ' 153' ' ' GLY . 3.3 p30 -33.67 136.64 0.11 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.906 0.384 . . . . 74.45 110.883 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 75.35 107.77 0.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.124 -0.489 . . . . 63.14 111.132 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 156' ' ' LEU . . . . . 0.471 HD12 HG13 ' A' ' 186' ' ' ILE . 0.7 OUTLIER -91.86 -55.21 3.55 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.258 -0.428 . . . . 75.02 110.949 179.924 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . 0.582 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -158.76 148.88 19.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.198 -0.456 . . . . 73.44 111.136 179.758 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 26.1 p-80 -110.41 122.59 48.07 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.262 -0.426 . . . . 74.34 110.88 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -110.52 161.1 16.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.231 -0.441 . . . . 74.42 111.075 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 18.9 m-30 -112.3 134.72 53.68 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.254 -0.43 . . . . 75.31 110.897 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -63.97 162.73 27.81 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.53 0.681 . . . . 71.14 111.091 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.73 71.59 1.49 Allowed 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.687 2.258 . . . . 74.44 112.366 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -136.08 110.1 0.78 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.776 -0.726 . . . . 72.32 112.537 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 67.1 165.93 0.22 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.89 0.376 . . . . 73.1 111.1 -179.839 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -54.72 -35.7 58.17 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.701 -0.762 . . . . 74.03 112.489 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.84 -19.53 63.46 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.896 0.379 . . . . 75.02 110.938 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -88.47 167.0 35.06 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.718 -0.753 . . . . 43.43 112.479 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 168' ' ' GLY . . . . . 0.41 ' O ' HG13 ' A' ' 134' ' ' ILE . . . 80.47 -1.95 79.91 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.81 -0.71 . . . . 74.31 112.482 -179.906 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -70.57 148.3 48.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.846 0.355 . . . . 63.41 110.835 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.3 130.16 56.04 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.215 -0.448 . . . . 74.21 111.047 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 26.5 m170 -129.69 132.18 46.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.224 -0.444 . . . . 72.53 110.885 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -114.23 138.94 49.83 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.235 -0.439 . . . . 71.44 110.849 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 57.8 t0 -70.63 97.82 1.4 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.157 -0.474 . . . . 74.11 110.877 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.92 -16.69 7.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.222 -0.445 . . . . 74.45 110.933 -179.904 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -78.39 -16.16 57.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.168 -0.469 . . . . 73.32 110.851 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -84.94 -173.54 4.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.21 -0.45 . . . . 71.41 110.885 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 45.6 mtt85 -111.75 109.73 19.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.142 -0.481 . . . . 74.32 110.872 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 70.7 m95 -109.75 138.27 46.36 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.199 -0.455 . . . . 74.32 110.884 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 11.4 t -177.76 163.54 1.86 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.279 -0.419 . . . . 74.13 111.165 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -127.29 -72.04 0.65 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.204 -0.453 . . . . 61.52 110.826 179.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -58.67 -16.94 32.21 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.668 -0.777 . . . . 62.41 112.5 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 182' ' ' SER . . . . . 0.411 ' O ' ' C ' ' A' ' 183' ' ' SER . 1.2 m -92.56 -24.32 18.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.853 0.359 . . . . 74.0 110.846 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 183' ' ' SER . . . . . 0.411 ' C ' ' O ' ' A' ' 182' ' ' SER . 4.5 p 37.36 51.82 1.18 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.187 -0.46 . . . . 64.12 110.832 -179.802 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 41.8 tp -109.18 -33.44 6.87 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.112 -0.495 . . . . 74.43 110.947 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -118.74 -138.51 5.87 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.686 -0.769 . . . . 74.22 112.401 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 186' ' ' ILE . . . . . 0.471 HG13 HD12 ' A' ' 156' ' ' LEU . 8.2 mm -79.39 101.76 4.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.908 0.385 . . . . 73.22 111.165 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -49.38 119.18 3.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.162 -0.472 . . . . 71.31 110.895 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 188' ' ' PHE . . . . . 0.57 ' HD2' ' HB3' ' A' ' 108' ' ' LEU . 1.0 OUTLIER -53.99 -33.03 55.92 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.194 -0.457 . . . . 75.45 110.87 -179.99 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . 0.409 HD21 HD12 ' A' ' 108' ' ' LEU . 0.2 OUTLIER -67.24 -48.25 68.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.11 -0.495 . . . . 60.14 110.913 -179.945 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 23.0 t80 -70.4 -37.01 74.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.234 -0.439 . . . . 74.22 110.891 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -72.65 -36.9 68.07 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.148 -0.478 . . . . 61.32 111.107 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 192' ' ' ALA . . . . . 0.448 ' O ' ' HB2' ' A' ' 196' ' ' LEU . . . -57.9 -45.08 87.02 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.209 -0.45 . . . . 52.32 111.159 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.58 -43.13 93.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.193 -0.458 . . . . 72.43 111.177 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 4.9 t60 -72.59 -38.23 67.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.3 -0.409 . . . . 71.44 110.902 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -75.17 -47.36 28.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.235 -0.439 . . . . 71.01 111.108 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 196' ' ' LEU . . . . . 0.498 HD22 ' N ' ' A' ' 196' ' ' LEU . 4.5 mm? -64.6 -43.72 92.87 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.27 -0.423 . . . . 74.52 110.908 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -57.4 -27.98 58.75 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.679 -0.772 . . . . 62.43 112.485 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 198' ' ' HIS . . . . . . . . . . . . . 4.8 m-70 -66.79 -43.88 82.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.764 0.316 . . . . 75.21 110.818 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.21 -21.83 64.2 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 73.13 110.837 -179.8 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 200' ' ' LEU . . . . . 0.431 HD22 ' CE2' ' A' ' 84' ' ' TRP . 4.3 mt -84.68 -0.93 55.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.142 -0.481 . . . . 75.12 110.97 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 83.48 -3.97 83.23 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.721 -0.752 . . . . 50.41 112.501 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 202' ' ' MET . . . . . . . . . . . . . 99.6 mmm -51.79 172.79 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.855 0.359 . . . . 71.04 110.853 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -132.73 160.17 23.71 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.746 -0.74 . . . . 64.44 112.433 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 22.6 m-70 -61.53 161.73 9.21 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.786 0.327 . . . . 74.32 110.852 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -125.05 147.49 48.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.213 -0.448 . . . . 72.42 110.846 -179.786 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 8.3 p -87.92 -3.93 58.88 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.153 -0.476 . . . . 72.22 110.877 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -70.93 137.77 85.11 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.659 0.742 . . . . 65.11 110.823 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -69.85 -6.23 18.14 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.693 2.262 . . . . 74.53 112.277 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -130.9 29.26 4.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.279 -0.419 . . . . 63.52 110.842 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 210' ' ' ALA . . . . . 0.432 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.43 145.65 26.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.277 -0.42 . . . . 64.4 111.134 179.912 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -66.91 -27.6 40.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.247 -0.433 . . . . 75.23 111.157 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 7.4 tpp -96.33 7.98 45.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.185 -0.461 . . . . 75.22 110.844 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 213' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -55.5 110.29 2.15 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.651 0.738 . . . . 73.43 110.962 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.69 -18.54 37.26 Favored 'Trans proline' 0 C--O 1.231 0.158 0 C-N-CA 122.747 2.298 . . . . 63.01 112.356 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.24 55.71 3.45 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.224 -0.444 . . . . 74.24 111.152 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 6.0 t80 . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 74.42 110.936 -179.895 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.934 0.397 . . . . 71.11 110.927 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -143.65 167.14 22.96 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.125 -0.489 . . . . 65.02 110.913 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.79 149.52 30.87 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.223 -0.444 . . . . 62.53 110.96 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 227' ' ' SER . . . . . 0.432 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 5.9 t -86.88 158.6 19.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.236 -0.438 . . . . 74.21 110.85 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -65.4 -65.1 0.72 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.129 -0.487 . . . . 74.54 110.933 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -55.42 -26.34 41.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.196 -0.456 . . . . 74.2 110.822 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 230' ' ' ASP . . . . . 0.407 ' HB2' ' HB3' ' A' ' 227' ' ' SER . 33.1 t70 -69.34 -48.4 61.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.231 -0.44 . . . . 74.23 110.872 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 231' ' ' ILE . . . . . . . . . . . . . 8.7 mt -68.49 -42.94 84.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.193 -0.458 . . . . 73.41 111.118 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 7.4 pttt -63.86 -32.38 73.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.137 -0.483 . . . . 73.32 110.85 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -62.95 -49.76 69.51 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.708 -0.758 . . . . 65.45 112.446 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 9.1 tt -72.97 -31.99 37.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.831 0.348 . . . . 74.41 111.187 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 11.5 mt-30 -70.9 -23.64 62.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.142 -0.481 . . . . 71.13 110.882 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 236' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.77 -28.46 61.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.175 -0.466 . . . . 74.41 110.865 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 237' ' ' LEU . . . . . . . . . . . . . 8.4 tt -97.98 -26.5 14.62 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.263 -0.426 . . . . 75.41 110.935 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 238' ' ' TYR . . . . . . . . . . . . . 15.1 m-85 -92.3 -35.28 13.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.465 . . . . 54.42 110.918 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.234 0 C-N-CA 120.708 -0.758 . . . . 72.22 112.481 179.961 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 22.1 t-105 . . . . . 0 C--O 1.23 0.071 0 CA-C-O 120.746 0.308 . . . . 71.22 110.912 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 71.6 tt0 -73.12 -36.95 66.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.264 -0.425 . . . . 72.51 110.932 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -65.0 -38.42 90.9 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 74.32 110.909 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.27 -39.05 74.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.13 -0.486 . . . . 74.22 111.116 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -69.74 -43.0 73.21 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.174 -0.466 . . . . 73.12 110.905 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -66.42 -31.36 72.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.2 -0.454 . . . . 72.4 110.846 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -61.22 -36.27 79.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.168 -0.469 . . . . 75.11 110.934 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -71.88 -21.02 61.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.06 -0.518 . . . . 75.43 110.868 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 4.2 ptmt -75.06 -28.84 60.52 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.235 -0.438 . . . . 75.45 110.841 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.7 ptp180 -86.35 -28.11 23.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.295 -0.412 . . . . 74.22 110.851 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -65.05 -18.15 65.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.18 -0.464 . . . . 75.2 110.895 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.169 -0.469 . . . . 74.4 110.869 -179.788 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.426 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 2.1 pp . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.792 0.329 . . . . 74.54 110.964 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.87 -53.13 61.64 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.198 -0.455 . . . . 73.13 110.981 179.874 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -66.05 -36.89 84.44 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.091 -0.504 . . . . 71.12 111.062 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.466 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.2 OUTLIER -65.34 -49.34 69.76 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.262 -0.426 . . . . 74.43 110.849 -179.969 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 35' ' ' LEU . 4.4 mt -63.64 -35.37 80.31 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.23 -0.441 . . . . 74.44 110.925 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 12.7 tmtt? -59.89 -45.83 91.27 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.19 -0.459 . . . . 74.2 110.877 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.466 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 3.2 pt-20 -60.91 -32.77 72.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.191 -0.459 . . . . 75.11 110.913 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 27.0 ttp -68.34 -34.1 75.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 63.43 110.954 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.418 ' HG3' ' HA ' ' A' ' 51' ' ' THR . 1.8 mm-40 -59.79 -39.59 85.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 75.32 110.878 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.6 mmpt? -70.56 -30.61 67.38 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.242 -0.436 . . . . 75.11 110.815 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 14.5 t80 -70.4 -42.22 71.95 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.255 -0.43 . . . . 73.32 110.893 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -82.19 -35.19 28.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.137 -0.483 . . . . 70.43 110.881 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 102.45 -7.81 54.32 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.777 -0.725 . . . . 64.42 112.479 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.07 138.34 91.13 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-O 121.649 0.737 . . . . 74.31 110.869 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.82 -52.12 0.34 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.677 2.252 . . . . 74.5 112.329 179.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -52.08 108.26 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.202 -0.454 . . . . 72.24 111.161 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.418 ' HA ' ' HG3' ' A' ' 43' ' ' GLN . 6.8 p -101.86 159.09 15.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.135 -0.484 . . . . 73.25 111.166 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 58.44 18.63 37.54 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.734 -0.746 . . . . 64.24 112.484 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 27.8 mmt -103.98 160.98 14.37 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.803 0.335 . . . . 75.23 110.899 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.403 ' HA ' ' HB ' ' A' ' 58' ' ' VAL . 25.8 tp -173.69 86.17 0.05 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.271 -0.422 . . . . 74.32 110.952 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.0 p30 174.72 -28.3 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.141 -0.481 . . . . 61.31 110.862 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 25.5 m -94.44 -100.19 0.15 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.244 -0.435 . . . . 75.25 110.844 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 3.3 tpp85 -84.79 -29.06 25.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.122 -0.49 . . . . 74.13 110.887 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.403 ' HB ' ' HA ' ' A' ' 54' ' ' LEU . 61.5 t -65.72 -41.03 89.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.153 -0.476 . . . . 72.2 111.092 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -75.16 -31.61 24.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.244 -0.435 . . . . 75.2 111.195 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -59.52 -44.23 93.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 73.45 110.86 179.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.452 HG13 ' N ' ' A' ' 62' ' ' MET . 1.3 pp -62.92 -29.03 46.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.149 -0.478 . . . . 74.52 111.12 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' MET . . . . . 0.452 ' N ' HG13 ' A' ' 61' ' ' ILE . 3.6 mmt -69.01 -35.03 76.2 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.215 -0.448 . . . . 74.01 110.852 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -88.56 -26.31 22.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.207 -0.452 . . . . 45.15 110.874 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.3 136.27 38.0 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.556 0.693 . . . . 75.32 110.891 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 127.62 14.88 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.621 2.214 . . . . 72.11 112.401 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 5.5 ttm180 -115.02 -88.05 0.58 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.271 -0.422 . . . . 73.22 110.864 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -146.02 156.39 43.45 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.17 -0.468 . . . . 72.31 110.935 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.508 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -98.22 21.05 48.02 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.796 -0.716 . . . . 64.23 112.462 -179.822 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -109.79 135.32 20.44 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.627 0.727 . . . . 74.23 111.193 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -69.78 156.24 63.8 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.715 2.277 . . . . 63.44 112.381 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -105.84 6.28 31.46 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.26 -0.427 . . . . 74.45 110.867 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.263 0 CA-C-N 116.197 -0.456 . . . . 73.52 111.053 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo . . . . . 0 C--O 1.232 0.191 0 CA-C-O 120.832 0.263 . . . . 72.25 112.351 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 26.2 mttp -92.68 165.47 12.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.229 -0.442 . . . . 72.53 110.891 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . 0.431 ' N ' ' HH ' ' A' ' 238' ' ' TYR . 54.5 m95 -48.66 127.7 14.0 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.191 -0.459 . . . . 73.31 110.981 179.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 15.1 t -115.23 -1.37 12.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.301 -0.409 . . . . 71.34 111.218 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 3.6 m -68.15 -175.94 0.66 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.18 -0.464 . . . . 73.12 110.829 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 2.8 mttt -92.8 -25.03 18.33 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.099 -0.501 . . . . 71.12 110.904 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -153.83 142.13 13.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.206 -0.452 . . . . 74.14 111.138 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 58.8 t -116.6 130.22 71.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 72.25 111.167 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 11.7 p -120.01 168.07 11.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.207 -0.452 . . . . 75.51 111.109 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 2.9 p90 -145.38 146.93 31.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.217 -0.447 . . . . 70.51 110.933 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -146.21 131.67 18.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.104 -0.498 . . . . 74.3 110.914 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 18.6 mm -74.99 127.2 36.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.138 -0.483 . . . . 72.4 111.096 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.516 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 6.5 t -86.38 -40.8 14.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.184 -0.462 . . . . 74.41 111.1 179.826 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 32.9 t -157.16 169.52 24.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.449 . . . . 64.24 110.852 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 11.9 p90 -127.45 155.09 44.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.143 -0.481 . . . . 74.1 110.973 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 3.9 t -95.03 141.26 28.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.116 -0.493 . . . . 75.33 111.16 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 3.6 ptm180 -52.62 -18.96 2.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.287 -0.415 . . . . 72.14 110.836 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.31 -37.75 88.07 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.252 -0.431 . . . . 74.13 110.778 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.3 mt -138.65 152.94 71.84 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.613 0.72 . . . . 72.52 110.925 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.69 151.12 69.41 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.788 2.325 . . . . 73.11 112.354 179.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 13.1 t-160 -51.27 -26.28 7.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.253 -0.43 . . . . 74.11 110.875 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 12.2 tt -77.53 -38.06 25.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.175 -0.466 . . . . 74.02 111.084 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 3.0 m -69.01 -40.33 78.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.202 -0.454 . . . . 54.24 111.131 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 93.5 t -72.16 -46.19 59.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.266 -0.424 . . . . 73.13 111.097 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.584 ' O ' HG21 ' A' ' 109' ' ' VAL . 45.6 t0 -59.35 -45.69 90.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.202 -0.453 . . . . 63.44 110.842 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -70.36 -33.53 71.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.186 -0.461 . . . . 75.02 110.815 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.578 ' HB3' ' HD2' ' A' ' 188' ' ' PHE . 0.0 OUTLIER -60.3 -49.09 78.99 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.246 -0.434 . . . . 75.05 110.888 -179.958 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.584 HG21 ' O ' ' A' ' 106' ' ' ASP . 1.5 m -55.62 -41.49 64.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.153 -0.476 . . . . 72.31 111.045 179.892 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.465 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 37.5 t -70.0 -33.76 72.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.183 -0.462 . . . . 72.14 110.819 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.92 -33.3 73.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.152 -0.476 . . . . 74.35 110.864 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -95.87 -40.28 9.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.225 -0.443 . . . . 74.32 111.092 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.24 -32.9 74.81 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.205 -0.452 . . . . 74.11 110.92 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 38.9 t30 -64.66 -35.51 81.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 75.15 110.846 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.49 -33.79 75.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.174 -0.466 . . . . 74.0 110.862 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 9.4 m95 -70.58 -52.47 21.36 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.186 -0.461 . . . . 75.23 110.904 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -60.24 -43.61 98.31 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.724 -0.751 . . . . 73.44 112.494 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.97 -19.06 60.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.714 0.292 . . . . 74.42 110.85 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . 0.434 ' HG2' HG13 ' A' ' 231' ' ' ILE . 0.2 OUTLIER -96.29 13.4 27.72 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.235 -0.438 . . . . 75.55 110.886 179.952 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 8.6 pt -146.89 147.04 28.32 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.55 0.691 . . . . 71.34 111.2 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 5.72 1.59 Allowed 'Trans proline' 0 C--O 1.233 0.245 0 C-N-CA 122.655 2.236 . . . . 75.35 112.32 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.427 ' HB3' ' H ' ' A' ' 123' ' ' HIS . 10.9 mt -61.12 -160.96 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.2 -0.454 . . . . 73.22 110.894 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . 0.427 ' H ' ' HB3' ' A' ' 122' ' ' LEU . 3.5 t-160 -150.67 123.18 8.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.228 -0.442 . . . . 74.12 110.803 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 11.1 m-30 -107.54 148.76 28.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.253 -0.43 . . . . 75.54 110.934 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.03 141.24 48.14 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.153 -0.476 . . . . 75.14 110.843 -179.884 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.8 139.71 35.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 74.04 110.841 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 19.1 m -102.91 133.43 46.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.228 -0.442 . . . . 50.13 111.046 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -146.68 -23.59 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.157 -0.474 . . . . 74.43 111.064 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -138.59 109.3 6.64 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.195 -0.457 . . . . 73.32 110.961 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 108.48 -159.37 14.27 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.727 -0.749 . . . . 62.11 112.496 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.75 155.4 18.15 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.734 0.302 . . . . 71.11 111.158 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -112.87 165.33 12.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.225 -0.443 . . . . 72.32 111.104 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -65.37 -60.31 3.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.25 -0.432 . . . . 75.41 110.85 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 19.3 mt -90.7 129.42 41.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.161 -0.472 . . . . 71.04 111.124 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' MET . . . . . 0.516 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 0.0 OUTLIER -107.85 122.97 47.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.136 -0.483 . . . . 72.43 110.869 179.882 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -105.64 95.73 4.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.239 -0.437 . . . . 70.04 111.132 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -130.96 166.62 22.6 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.73 -0.747 . . . . 63.34 112.542 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 60.3 m-85 -105.28 149.14 26.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.912 0.387 . . . . 74.01 110.848 -179.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . 173.89 167.23 0.2 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.116 -0.493 . . . . 71.21 111.105 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 33.3 mtt180 -104.19 173.39 6.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.217 -0.447 . . . . 72.34 110.871 -179.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -57.46 -15.3 16.41 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.681 -0.771 . . . . 74.24 112.475 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -100.91 14.17 32.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.85 0.357 . . . . 75.03 111.09 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 8.9 p80 -68.19 -33.35 74.28 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.249 -0.432 . . . . 73.45 110.881 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 147.28 47.13 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.765 -0.731 . . . . 60.43 112.491 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -158.82 149.57 20.04 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.763 0.316 . . . . 72.14 110.857 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 146' ' ' SER . . . . . 0.475 ' O ' ' CB ' ' A' ' 147' ' ' TYR . 49.0 p -63.73 99.12 0.21 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.224 -0.444 . . . . 64.54 110.888 -179.777 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 147' ' ' TYR . . . . . 0.475 ' CB ' ' O ' ' A' ' 146' ' ' SER . 0.2 OUTLIER 163.04 121.21 0.0 OUTLIER Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.704 0.764 . . . . 73.4 110.848 -179.874 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.74 138.47 37.95 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.705 2.27 . . . . 74.53 112.372 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 149' ' ' PHE . . . . . 0.485 ' C ' ' H ' ' A' ' 151' ' ' GLY . 7.6 p90 -53.84 -42.38 68.44 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.209 -0.451 . . . . 70.0 110.841 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 75.61 -21.93 0.29 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.184 -0.462 . . . . 72.24 110.927 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . 0.485 ' H ' ' C ' ' A' ' 149' ' ' PHE . . . 78.83 -159.49 45.89 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.678 -0.773 . . . . 75.42 112.515 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.67 142.41 48.26 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.711 2.274 . . . . 75.11 112.363 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . 0.437 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 104.34 -137.52 13.62 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.752 -0.737 . . . . 70.32 112.522 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 154' ' ' ASN . . . . . 0.437 ' C ' ' O ' ' A' ' 153' ' ' GLY . 3.4 p30 -34.86 141.32 0.06 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.944 0.402 . . . . 74.45 110.826 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 75.22 90.07 0.08 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.15 -0.477 . . . . 63.14 111.16 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 156' ' ' LEU . . . . . 0.466 HD12 HG13 ' A' ' 186' ' ' ILE . 0.0 OUTLIER -71.9 -59.35 2.79 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.162 -0.472 . . . . 75.02 110.914 179.953 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . 0.508 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -161.59 148.82 14.57 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.198 -0.455 . . . . 73.44 111.088 179.779 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 15.4 p-80 -103.47 124.38 48.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.194 -0.457 . . . . 74.34 110.862 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -110.58 159.41 17.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.225 -0.443 . . . . 74.42 111.083 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 14.2 m-85 -112.58 152.24 29.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.217 -0.447 . . . . 75.31 110.88 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -81.67 163.64 53.01 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.591 0.71 . . . . 71.14 111.113 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.81 79.28 0.97 Allowed 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.667 2.245 . . . . 74.44 112.354 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -148.87 122.8 1.53 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.752 -0.737 . . . . 72.32 112.504 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 1.1 m 66.43 149.75 0.05 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.803 0.335 . . . . 73.1 111.138 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -52.76 -45.45 60.65 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.687 -0.768 . . . . 74.03 112.474 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 10.1 tt -64.25 -39.9 94.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.891 0.377 . . . . 75.02 110.993 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -78.79 170.49 54.77 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.788 -0.72 . . . . 43.43 112.439 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 80.46 22.86 61.62 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.765 -0.731 . . . . 74.31 112.457 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 85.5 m-20 -96.32 165.13 12.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.853 0.359 . . . . 63.41 110.886 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.44 130.9 55.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.196 -0.456 . . . . 74.21 111.08 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 25.0 m170 -125.05 158.74 33.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.224 -0.444 . . . . 72.53 110.861 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -140.87 137.73 33.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.252 -0.431 . . . . 71.44 110.884 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 173' ' ' ASP . . . . . 0.415 ' HB3' ' OE1' ' A' ' 176' ' ' GLU . 13.6 t0 -70.85 100.92 2.02 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.133 -0.485 . . . . 74.11 110.861 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.05 -11.45 39.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.173 -0.467 . . . . 74.45 110.903 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -78.79 -16.53 57.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.143 -0.48 . . . . 73.32 110.85 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 176' ' ' GLU . . . . . 0.415 ' OE1' ' HB3' ' A' ' 173' ' ' ASP . 1.4 mt-10 -90.53 -168.83 2.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.253 -0.431 . . . . 71.41 110.893 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 54.1 mtt85 -115.64 121.49 42.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.162 -0.472 . . . . 74.32 110.869 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 60.4 m95 -116.92 144.42 44.56 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.213 -0.449 . . . . 74.32 110.916 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 2.5 t -177.0 163.81 2.21 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.224 -0.444 . . . . 74.13 111.139 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -125.07 -70.0 0.77 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.194 -0.457 . . . . 61.52 110.845 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -67.74 -10.8 59.09 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.68 -0.772 . . . . 62.41 112.529 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 182' ' ' SER . . . . . 0.464 ' O ' ' C ' ' A' ' 183' ' ' SER . 0.3 OUTLIER -95.07 -24.54 16.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.914 0.388 . . . . 74.0 110.881 -179.723 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 183' ' ' SER . . . . . 0.464 ' C ' ' O ' ' A' ' 182' ' ' SER . 56.8 m 32.94 66.17 0.21 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.076 -0.511 . . . . 64.12 110.898 -179.79 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 6.4 tp -116.9 -33.61 4.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.162 -0.472 . . . . 74.43 110.885 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -128.91 -128.26 3.04 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.756 -0.735 . . . . 74.22 112.506 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 186' ' ' ILE . . . . . 0.466 HG13 HD12 ' A' ' 156' ' ' LEU . 4.6 mm -79.33 97.56 2.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.856 0.36 . . . . 73.22 111.178 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -54.75 121.17 7.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.177 -0.465 . . . . 71.31 110.91 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 188' ' ' PHE . . . . . 0.578 ' HD2' ' HB3' ' A' ' 108' ' ' LEU . 1.3 t80 -54.43 -33.16 58.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.145 -0.479 . . . . 75.45 110.867 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.15 -47.93 69.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.134 -0.484 . . . . 60.14 110.965 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 85.7 t80 -70.14 -38.09 75.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.142 -0.481 . . . . 74.22 110.962 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -72.68 -35.4 67.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.098 -0.501 . . . . 61.32 111.027 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 192' ' ' ALA . . . . . 0.449 ' O ' ' HB2' ' A' ' 196' ' ' LEU . . . -56.8 -44.88 82.38 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.277 -0.42 . . . . 52.32 111.143 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -58.87 -43.04 90.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 72.43 111.177 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 11.7 t-160 -72.88 -38.02 67.13 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.166 -0.47 . . . . 71.44 110.861 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -75.5 -47.44 27.02 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.15 -0.477 . . . . 71.01 111.104 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 196' ' ' LEU . . . . . 0.459 HD22 ' N ' ' A' ' 196' ' ' LEU . 4.6 mm? -63.19 -43.98 96.67 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.234 -0.439 . . . . 74.52 110.864 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -59.14 -28.7 64.43 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.714 -0.755 . . . . 62.43 112.425 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 198' ' ' HIS . . . . . . . . . . . . . 5.1 m-70 -65.69 -32.88 74.68 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.789 0.328 . . . . 75.21 110.817 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.57 -21.17 60.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.24 -0.436 . . . . 73.13 110.849 -179.768 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 200' ' ' LEU . . . . . 0.424 ' HA ' ' CD1' ' A' ' 84' ' ' TRP . 0.6 OUTLIER -88.72 2.3 53.61 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.131 -0.486 . . . . 75.12 110.916 179.946 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 84.12 -9.02 64.78 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.718 -0.753 . . . . 50.41 112.446 179.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 202' ' ' MET . . . . . . . . . . . . . 37.6 tpp -51.51 138.94 21.2 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.806 0.336 . . . . 71.04 110.855 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -105.12 159.06 15.8 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.744 -0.741 . . . . 64.44 112.53 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 16.0 m-70 -55.52 163.38 1.29 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.813 0.34 . . . . 74.32 110.838 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -123.61 147.81 47.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.184 -0.462 . . . . 72.42 110.834 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -88.14 -4.03 58.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.128 -0.487 . . . . 72.22 110.854 -179.81 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -70.99 138.58 85.06 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.626 0.727 . . . . 65.11 110.836 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 -8.96 24.91 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.626 2.217 . . . . 74.53 112.37 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -127.98 29.71 5.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.237 -0.438 . . . . 63.52 110.934 179.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 210' ' ' ALA . . . . . 0.451 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.37 145.86 26.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.201 -0.454 . . . . 64.4 111.059 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -67.73 -28.77 42.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.246 -0.434 . . . . 75.23 111.115 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.75 8.84 42.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.149 -0.478 . . . . 75.22 110.908 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 213' ' ' TYR . . . . . 0.401 ' CE2' ' HB ' ' A' ' 215' ' ' THR . 1.8 t80 -55.73 115.02 8.42 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.703 0.763 . . . . 73.43 110.925 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.67 -17.79 37.78 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.711 2.274 . . . . 63.01 112.389 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 215' ' ' THR . . . . . 0.401 ' HB ' ' CE2' ' A' ' 213' ' ' TYR . 0.2 OUTLIER -83.77 55.6 3.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.215 -0.448 . . . . 74.24 111.139 -179.946 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 5.8 t80 . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 116.206 -0.452 . . . . 74.42 110.942 -179.905 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.925 0.393 . . . . 71.11 110.882 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.75 154.67 43.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 65.02 110.91 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 226' ' ' LEU . . . . . 0.406 HD12 ' HG2' ' A' ' 119' ' ' GLU . 12.0 mt -69.98 148.66 48.62 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.268 -0.424 . . . . 62.53 110.931 179.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 227' ' ' SER . . . . . 0.451 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 0.0 OUTLIER -86.65 155.43 20.41 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.154 -0.476 . . . . 74.21 110.861 -179.886 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 42.6 mt-30 -67.45 -66.09 0.6 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.109 -0.496 . . . . 74.54 110.98 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -55.74 -26.63 46.48 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.156 -0.474 . . . . 74.2 110.864 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -69.1 -50.66 46.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.141 -0.481 . . . . 74.23 110.881 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 231' ' ' ILE . . . . . 0.434 HG13 ' HG2' ' A' ' 119' ' ' GLU . 2.8 mm -70.43 -42.18 78.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.222 -0.445 . . . . 73.41 111.118 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.47 -32.34 64.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.22 -0.445 . . . . 73.32 110.904 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -64.55 -50.01 61.53 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.753 -0.737 . . . . 65.45 112.437 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 5.5 tt -73.19 -30.81 32.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.731 0.301 . . . . 74.41 111.089 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -66.38 -24.16 66.45 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.256 -0.429 . . . . 71.13 110.923 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 236' ' ' LYS . . . . . 0.449 ' HE2' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.1 -20.61 60.21 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.239 -0.437 . . . . 74.41 110.904 179.918 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 237' ' ' LEU . . . . . 0.449 ' HB2' ' HE2' ' A' ' 236' ' ' LYS . 9.8 tt -97.21 -31.38 12.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.217 -0.447 . . . . 75.41 110.935 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 238' ' ' TYR . . . . . 0.431 ' HH ' ' N ' ' A' ' 84' ' ' TRP . 26.4 m-85 -92.16 -35.02 14.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 54.42 110.901 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.336 0 C-N-CA 120.69 -0.767 . . . . 72.22 112.47 -179.988 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 70.0 t-105 . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.678 0.275 . . . . 71.22 110.872 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -72.2 -35.16 68.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.314 -0.403 . . . . 72.51 110.886 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -71.34 -36.51 71.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.113 -0.494 . . . . 74.32 110.946 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.82 -44.1 86.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.254 -0.43 . . . . 74.22 111.076 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.511 ' HG3' ' N ' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -73.79 -31.92 63.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.264 -0.425 . . . . 73.12 110.865 -179.92 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . 0.511 ' N ' ' HG3' ' A' ' 16' ' ' GLN . 74.5 m-20 -77.72 -31.09 52.05 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.259 -0.428 . . . . 72.4 110.898 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -59.75 -36.32 76.4 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.175 -0.466 . . . . 75.11 110.902 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.24 -20.99 61.45 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.19 -0.459 . . . . 75.43 110.911 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 4.2 ptmt -74.0 -27.86 61.17 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.177 -0.465 . . . . 75.45 110.877 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.0 ptp180 -86.34 -27.73 24.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.23 -0.441 . . . . 74.22 110.804 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -60.16 -21.18 61.34 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.219 -0.446 . . . . 75.2 110.859 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.134 -0.484 . . . . 74.4 110.952 -179.83 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.8 mp . . . . . 0 C--O 1.23 0.071 0 CA-C-O 120.781 0.325 . . . . 74.54 110.952 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -61.8 -51.47 68.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.166 -0.47 . . . . 73.13 110.913 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -61.48 -50.51 72.47 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.116 -0.493 . . . . 71.12 111.138 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.83 -38.28 81.57 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.152 -0.476 . . . . 74.43 110.92 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.6 mp -61.63 -39.45 91.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.161 -0.472 . . . . 74.44 110.852 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 37.9 mttp -66.22 -46.71 76.25 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.205 -0.452 . . . . 74.2 110.935 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -70.57 -33.04 70.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.188 -0.46 . . . . 75.11 110.903 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.31 -47.5 70.38 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.164 -0.471 . . . . 63.43 110.884 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.523 ' HB3' ' HB2' ' A' ' 48' ' ' LEU . 31.4 mt-30 -59.0 -42.8 90.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.225 -0.443 . . . . 75.32 110.96 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.3 mmpt? -59.6 -27.76 66.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.223 -0.444 . . . . 75.11 110.874 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -70.56 -37.67 74.04 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.24 -0.436 . . . . 73.32 110.834 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 -83.94 9.52 12.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.171 -0.468 . . . . 70.43 110.879 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . 0.439 ' HA2' ' HB3' ' A' ' 206' ' ' SER . . . 76.55 11.81 84.89 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.782 -0.723 . . . . 64.42 112.474 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.523 ' HB2' ' HB3' ' A' ' 43' ' ' GLN . 6.1 mt -76.4 121.73 85.44 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.56 0.695 . . . . 74.31 110.952 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.83 -44.77 1.84 Allowed 'Trans proline' 0 C--O 1.231 0.16 0 C-N-CA 122.643 2.229 . . . . 74.5 112.35 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 13.1 pt -58.87 129.67 21.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.193 -0.458 . . . . 72.24 111.144 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 76.5 p -115.2 128.88 56.45 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.127 -0.488 . . . . 73.25 111.179 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 90.95 30.03 11.93 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.746 -0.74 . . . . 64.24 112.45 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.6 mmt -130.98 133.91 46.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.873 0.368 . . . . 75.23 110.845 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.438 ' HA ' ' HB ' ' A' ' 58' ' ' VAL . 17.3 tp -154.13 95.94 1.89 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.114 -0.493 . . . . 74.32 110.946 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 171.01 -26.48 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.198 -0.455 . . . . 61.31 110.93 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 18.6 m -89.38 -99.62 0.09 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.118 -0.492 . . . . 75.25 110.855 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 12.2 tpt85 -84.53 -27.42 27.37 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.199 -0.455 . . . . 74.13 110.905 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.438 ' HB ' ' HA ' ' A' ' 54' ' ' LEU . 24.8 t -58.06 -44.31 86.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.143 -0.48 . . . . 72.2 111.119 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 9.9 mm -74.55 -30.89 26.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.147 -0.479 . . . . 75.2 111.219 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -59.2 -35.04 72.89 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.119 -0.491 . . . . 73.45 110.892 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -76.12 -29.18 19.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.194 -0.457 . . . . 74.52 111.13 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 7.0 mtt -61.76 -39.48 91.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.192 -0.458 . . . . 74.01 110.872 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -81.51 -22.73 37.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.22 -0.445 . . . . 45.15 110.873 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.1 mtmt -85.22 126.45 67.31 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.565 0.698 . . . . 75.32 110.95 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.66 140.1 42.22 Favored 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.72 2.28 . . . . 72.11 112.368 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -134.87 -77.72 0.45 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.254 -0.43 . . . . 73.22 110.901 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -145.26 148.81 33.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.469 . . . . 72.31 110.926 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.558 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -106.46 28.31 13.94 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.678 -0.773 . . . . 64.23 112.52 -179.909 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -106.12 134.26 19.84 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 121.622 0.725 . . . . 74.23 111.135 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.7 132.69 23.96 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.706 2.27 . . . . 63.44 112.326 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -93.29 22.16 5.42 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.245 -0.434 . . . . 74.45 110.887 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 3.1 m . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.154 -0.475 . . . . 73.52 111.124 179.958 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo . . . . . 0 C--O 1.231 0.166 0 CA-C-O 120.811 0.255 . . . . 72.25 112.334 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.414 ' HD2' ' CD2' ' A' ' 237' ' ' LEU . 9.4 mttt -106.56 171.0 7.59 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.189 -0.46 . . . . 72.53 110.954 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 61.0 m95 -56.53 131.15 47.85 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.239 -0.437 . . . . 73.31 110.933 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 4.8 t -115.19 -16.34 11.56 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.172 -0.467 . . . . 71.34 111.089 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 3.3 m -59.06 172.89 0.51 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.247 -0.433 . . . . 73.12 110.887 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 2.8 mptp? -85.04 -21.17 29.51 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.124 -0.489 . . . . 71.12 110.931 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -154.8 143.57 13.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.197 -0.456 . . . . 74.14 111.111 179.836 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 25.7 t -119.64 130.44 74.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.167 -0.47 . . . . 72.25 111.171 179.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 43.5 p -115.77 163.53 15.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.471 . . . . 75.51 111.1 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 4.7 p90 -145.96 146.22 30.95 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.207 -0.451 . . . . 70.51 110.923 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 3.7 ttt-85 -151.69 139.09 19.46 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.131 -0.486 . . . . 74.3 110.849 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 11.1 mm -74.84 131.28 35.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.162 -0.472 . . . . 72.4 111.141 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.44 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 9.3 t -88.6 -40.74 13.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.461 . . . . 74.41 111.183 179.812 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -151.52 169.36 22.27 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.128 -0.487 . . . . 64.24 110.792 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 13.8 p90 -129.63 155.08 46.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.11 -0.496 . . . . 74.1 110.98 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 2.1 t -102.79 141.84 34.92 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.183 -0.462 . . . . 75.33 111.194 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.44 -18.72 1.78 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.27 -0.423 . . . . 72.14 110.866 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -65.16 -37.32 87.0 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.158 -0.474 . . . . 74.13 110.847 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.3 mp -142.37 152.82 61.62 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.681 0.753 . . . . 72.52 110.858 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . 0.413 ' HB2' HG21 ' A' ' 103' ' ' ILE . 53.4 Cg_endo -69.76 150.97 68.92 Favored 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 122.689 2.259 . . . . 73.11 112.337 179.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 3.7 t-160 -52.7 -25.62 11.53 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.225 -0.443 . . . . 74.11 110.882 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.413 HG21 ' HB2' ' A' ' 101' ' ' PRO . 13.9 tt -77.36 -39.2 27.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.15 -0.477 . . . . 74.02 111.098 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 3.6 m -69.13 -36.21 77.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.18 -0.463 . . . . 54.24 111.181 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 60.2 t -71.93 -42.91 68.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.226 -0.443 . . . . 73.13 111.126 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.622 ' O ' HG22 ' A' ' 109' ' ' VAL . 0.0 OUTLIER -67.02 -37.19 83.69 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.171 -0.468 . . . . 63.44 110.845 179.92 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . 0.504 ' HG3' ' N ' ' A' ' 108' ' ' LEU . 0.0 OUTLIER -70.72 -33.27 70.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.172 -0.467 . . . . 75.02 110.891 -179.876 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.522 ' HB3' ' HD1' ' A' ' 188' ' ' PHE . 0.0 OUTLIER -66.44 -47.77 72.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.21 -0.45 . . . . 75.05 110.916 -179.978 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.622 HG22 ' O ' ' A' ' 106' ' ' ASP . 1.5 m -55.03 -42.99 67.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.146 -0.479 . . . . 72.31 111.091 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.493 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 30.2 t -70.62 -33.8 71.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.256 -0.429 . . . . 72.14 110.858 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.02 -33.11 73.76 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.17 -0.468 . . . . 74.35 110.913 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.7 -40.14 9.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.188 -0.46 . . . . 74.32 111.048 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.43 ' HB2' ' HG ' ' A' ' 196' ' ' LEU . 0.4 OUTLIER -64.73 -33.26 75.55 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.249 -0.432 . . . . 74.11 110.909 -179.997 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -66.38 -34.89 78.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.183 -0.462 . . . . 75.15 110.861 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.24 -33.33 71.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 74.0 110.843 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 6.3 m95 -70.16 -42.76 72.05 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.232 -0.44 . . . . 75.23 110.898 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -72.89 -40.81 51.21 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.735 -0.745 . . . . 73.44 112.43 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.3 ptpt -61.34 -14.52 27.75 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.802 0.334 . . . . 74.42 110.897 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.9 mm-40 -100.69 13.39 35.0 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.241 -0.436 . . . . 75.55 110.838 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . 0.527 ' C ' ' H ' ' A' ' 122' ' ' LEU . 6.6 pt -147.99 144.55 19.12 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.635 0.731 . . . . 71.34 111.099 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.72 24.57 0.17 Allowed 'Trans proline' 0 C--O 1.232 0.221 0 C-N-CA 122.673 2.249 . . . . 75.35 112.367 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.527 ' H ' ' C ' ' A' ' 120' ' ' ILE . 6.3 mt -77.46 -159.71 0.15 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.167 -0.47 . . . . 73.22 110.902 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . 0.458 ' H ' ' HB3' ' A' ' 122' ' ' LEU . 3.4 t-160 -151.19 120.98 7.03 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.184 -0.462 . . . . 74.12 110.934 179.852 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 11.0 m-30 -110.36 148.44 31.97 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.224 -0.443 . . . . 75.54 110.891 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.91 141.35 50.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.125 -0.489 . . . . 75.14 110.853 -179.872 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.14 145.25 31.13 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.247 -0.433 . . . . 74.04 110.875 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 30.4 m -103.3 126.58 57.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.248 -0.433 . . . . 50.13 111.097 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -142.07 -22.62 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.116 -0.493 . . . . 74.43 111.187 179.859 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -140.72 109.15 5.86 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.104 -0.498 . . . . 73.32 110.92 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.07 -162.24 13.53 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.747 -0.74 . . . . 62.11 112.521 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 3.2 m -101.79 156.61 17.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.79 0.329 . . . . 71.11 111.13 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -111.22 165.2 12.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.218 -0.446 . . . . 72.32 111.136 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -69.05 -55.33 11.13 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.188 -0.46 . . . . 75.41 110.883 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 41.1 mt -82.7 131.06 34.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.196 -0.456 . . . . 71.04 111.12 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' MET . . . . . 0.44 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 27.2 mmt -108.06 118.37 36.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.162 -0.472 . . . . 72.43 110.964 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -106.16 89.87 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.316 -0.402 . . . . 70.04 111.166 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -129.53 169.45 20.73 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.774 -0.726 . . . . 63.34 112.509 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' PHE . . . . . 0.425 ' O ' ' CB ' ' A' ' 139' ' ' ALA . 45.5 m-85 -106.04 147.04 29.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.888 0.375 . . . . 74.01 110.945 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.425 ' CB ' ' O ' ' A' ' 138' ' ' PHE . . . 167.48 166.19 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.142 -0.481 . . . . 71.21 111.105 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . 0.408 ' HB2' ' HB3' ' A' ' 149' ' ' PHE . 1.0 OUTLIER -109.28 174.36 5.9 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.216 -0.447 . . . . 72.34 110.832 -179.939 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . 0.474 ' H ' ' HA ' ' A' ' 149' ' ' PHE . . . -54.13 -17.68 8.07 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.783 -0.722 . . . . 74.24 112.461 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -89.36 13.29 13.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.848 0.356 . . . . 75.03 111.159 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 5.0 p80 -81.09 0.91 33.96 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.191 -0.458 . . . . 73.45 110.859 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 104.61 47.1 1.23 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.828 -0.701 . . . . 60.43 112.521 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -159.46 174.21 15.03 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.795 0.331 . . . . 72.14 110.885 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 57.7 m -63.98 176.42 0.97 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.227 -0.442 . . . . 64.54 110.848 -179.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 64.91 121.39 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.599 0.714 . . . . 73.4 110.908 -179.913 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.82 151.29 68.67 Favored 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.627 2.218 . . . . 74.53 112.335 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 149' ' ' PHE . . . . . 0.518 ' O ' ' CG ' ' A' ' 150' ' ' ASP . 1.5 p90 -53.93 -30.22 45.51 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.192 -0.458 . . . . 70.0 110.931 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . 0.518 ' CG ' ' O ' ' A' ' 149' ' ' PHE . 2.9 p30 50.03 15.45 0.18 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.135 -0.484 . . . . 72.24 110.851 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . 0.407 ' C ' ' O ' ' A' ' 150' ' ' ASP . . . 37.5 -154.64 0.01 OUTLIER Glycine 0 N--CA 1.453 -0.228 0 C-N-CA 120.698 -0.763 . . . . 75.42 112.518 -179.925 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 143.51 51.25 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.627 2.218 . . . . 75.11 112.389 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . 0.448 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 105.0 -132.14 10.96 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.809 -0.71 . . . . 70.32 112.493 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 154' ' ' ASN . . . . . 0.448 ' C ' ' O ' ' A' ' 153' ' ' GLY . 2.7 p30 -34.62 142.51 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.954 0.407 . . . . 74.45 110.907 -179.925 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 69.59 110.06 0.05 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.21 -0.45 . . . . 63.14 111.16 -179.921 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 156' ' ' LEU . . . . . 0.49 HD11 HG13 ' A' ' 186' ' ' ILE . 0.6 OUTLIER -87.97 -54.5 4.2 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.15 -0.477 . . . . 75.02 110.947 179.965 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . 0.558 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -163.84 149.18 10.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.209 -0.451 . . . . 73.44 111.092 179.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 33.9 p-80 -108.1 123.36 48.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.2 -0.455 . . . . 74.34 110.771 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -111.05 160.23 17.04 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.154 -0.475 . . . . 74.42 111.152 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -110.89 150.77 28.71 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.285 -0.416 . . . . 75.31 110.892 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -79.26 162.1 65.27 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.607 0.718 . . . . 71.14 111.116 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.74 77.82 1.04 Allowed 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.704 2.269 . . . . 74.44 112.315 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -135.18 121.5 2.59 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.697 -0.763 . . . . 72.32 112.52 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 62.61 -173.64 0.15 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.817 0.342 . . . . 73.1 111.144 -179.825 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -79.09 -49.79 6.17 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.815 -0.707 . . . . 74.03 112.527 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 6.1 tt -63.78 -37.17 86.37 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.863 0.363 . . . . 75.02 110.874 -179.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -79.18 157.5 42.97 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.725 -0.75 . . . . 43.43 112.454 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 94.42 22.9 23.22 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.719 -0.753 . . . . 74.31 112.542 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 80.6 m-20 -94.4 168.49 10.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.877 0.37 . . . . 63.41 110.789 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -117.11 130.83 56.89 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.124 -0.489 . . . . 74.21 111.042 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 28.1 m170 -126.11 132.14 51.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.2 -0.454 . . . . 72.53 110.85 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 172' ' ' PHE . . . . . 0.413 ' HA ' ' HB3' ' A' ' 157' ' ' ALA . 32.3 m-85 -113.75 139.97 48.66 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.214 -0.448 . . . . 71.44 110.876 -179.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 55.3 t0 -71.56 100.25 2.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.112 -0.494 . . . . 74.11 110.831 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.62 -16.53 10.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.227 -0.442 . . . . 74.45 110.823 -179.87 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -78.46 -16.19 57.81 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.208 -0.451 . . . . 73.32 110.806 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -83.59 -174.54 5.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.255 -0.43 . . . . 71.41 110.969 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 12.9 mtm180 -113.23 116.95 30.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.207 -0.451 . . . . 74.32 110.907 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 44.2 m95 -116.86 137.44 52.21 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.235 -0.439 . . . . 74.32 110.897 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 5.0 t -176.58 163.69 2.42 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.219 -0.446 . . . . 74.13 111.143 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -123.99 -68.69 0.85 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.204 -0.453 . . . . 61.52 110.842 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -66.8 -10.84 56.46 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.755 -0.736 . . . . 62.41 112.492 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 182' ' ' SER . . . . . 0.448 ' O ' ' C ' ' A' ' 183' ' ' SER . 0.3 OUTLIER -96.59 -24.32 16.09 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.912 0.387 . . . . 74.0 110.915 -179.781 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 183' ' ' SER . . . . . 0.448 ' C ' ' O ' ' A' ' 182' ' ' SER . 97.4 p 34.02 63.3 0.41 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.131 -0.486 . . . . 64.12 110.825 -179.9 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 24.8 tp -116.91 -33.64 4.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.18 -0.464 . . . . 74.43 110.889 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -124.51 -135.76 4.49 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.699 -0.762 . . . . 74.22 112.484 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 186' ' ' ILE . . . . . 0.49 HG13 HD11 ' A' ' 156' ' ' LEU . 7.1 mm -79.36 100.09 3.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.775 0.322 . . . . 73.22 111.162 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -50.75 123.79 9.72 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.131 -0.486 . . . . 71.31 110.816 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 188' ' ' PHE . . . . . 0.522 ' HD1' ' HB3' ' A' ' 108' ' ' LEU . 1.6 t80 -54.03 -35.42 61.94 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.121 -0.49 . . . . 75.45 110.873 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.27 -47.11 71.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.122 -0.49 . . . . 60.14 110.955 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.16 -40.86 77.92 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.234 -0.439 . . . . 74.22 110.934 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -70.16 -35.05 73.73 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.128 -0.487 . . . . 61.32 111.079 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 192' ' ' ALA . . . . . 0.47 ' HB1' HD23 ' A' ' 196' ' ' LEU . . . -56.81 -43.24 80.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.216 -0.447 . . . . 52.32 111.102 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -57.86 -42.63 84.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.21 -0.45 . . . . 72.43 111.117 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 5.7 t-160 -73.46 -40.23 64.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.182 -0.463 . . . . 71.44 110.905 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -70.69 -48.85 52.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.139 -0.482 . . . . 71.01 111.059 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 196' ' ' LEU . . . . . 0.47 HD23 ' HB1' ' A' ' 192' ' ' ALA . 4.2 mm? -64.04 -46.6 83.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 74.52 110.939 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -55.06 -31.97 56.36 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.74 -0.743 . . . . 62.43 112.429 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 198' ' ' HIS . . . . . . . . . . . . . 4.5 m-70 -65.54 -36.42 83.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.855 0.36 . . . . 75.21 110.826 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 29.9 t -67.38 -21.05 65.63 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.187 -0.46 . . . . 73.13 110.871 -179.755 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -90.31 -0.07 57.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.141 -0.482 . . . . 75.12 110.935 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 85.01 -7.89 72.83 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.692 -0.766 . . . . 50.41 112.449 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 202' ' ' MET . . . . . . . . . . . . . 28.3 tpp -50.05 139.36 14.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.797 0.332 . . . . 71.04 110.966 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -101.17 159.08 18.85 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.776 -0.726 . . . . 64.44 112.535 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 22.5 m-70 -56.99 154.81 9.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.791 0.329 . . . . 74.32 110.851 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -119.3 145.05 46.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.234 -0.439 . . . . 72.42 110.852 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 206' ' ' SER . . . . . 0.439 ' HB3' ' HA2' ' A' ' 47' ' ' GLY . 1.7 m -87.97 -4.26 58.83 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.155 -0.475 . . . . 72.22 110.805 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -71.38 137.7 83.85 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.635 0.731 . . . . 65.11 110.835 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -69.71 -9.84 27.11 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.704 2.269 . . . . 74.53 112.368 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 -122.01 24.72 9.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.145 -0.479 . . . . 63.52 110.858 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 210' ' ' ALA . . . . . 0.424 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.33 145.17 26.44 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.185 -0.461 . . . . 64.4 111.092 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -69.5 -27.71 35.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.185 -0.461 . . . . 75.23 111.163 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -92.1 3.65 54.83 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.205 -0.452 . . . . 75.22 110.841 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 213' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -55.54 110.43 2.25 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-O 121.652 0.739 . . . . 73.43 110.934 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 -18.07 37.17 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.685 2.257 . . . . 63.01 112.31 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -84.11 58.1 4.57 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.247 -0.433 . . . . 74.24 111.136 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 . . . . . 0 C--N 1.328 -0.351 0 CA-C-N 116.246 -0.434 . . . . 74.42 110.907 -179.938 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.886 0.374 . . . . 71.11 110.922 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -143.23 -167.74 2.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.109 -0.496 . . . . 65.02 110.905 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.3 148.67 31.32 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.208 -0.451 . . . . 62.53 110.902 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 227' ' ' SER . . . . . 0.424 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 2.0 t -87.12 157.4 19.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.192 -0.458 . . . . 74.21 110.926 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -63.44 -63.07 1.28 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.12 -0.491 . . . . 74.54 110.871 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -55.74 -27.77 52.4 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.212 -0.449 . . . . 74.2 110.897 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.22 -48.51 61.76 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.275 -0.42 . . . . 74.23 110.805 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 231' ' ' ILE . . . . . . . . . . . . . 8.3 mt -68.23 -43.07 84.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.213 -0.449 . . . . 73.41 111.1 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 11.8 pttp -66.09 -33.03 74.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.157 -0.474 . . . . 73.32 110.91 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -63.18 -46.78 92.41 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.784 -0.722 . . . . 65.45 112.435 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 7.0 tt -72.9 -30.77 33.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.74 0.305 . . . . 74.41 111.066 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -65.87 -24.3 66.84 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.214 -0.448 . . . . 71.13 110.862 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 236' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.64 -28.29 60.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.259 -0.428 . . . . 74.41 110.913 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 237' ' ' LEU . . . . . 0.414 ' CD2' ' HD2' ' A' ' 83' ' ' LYS . 7.0 tt -97.77 -31.0 12.46 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.2 -0.455 . . . . 75.41 110.892 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 238' ' ' TYR . . . . . 0.413 ' CE2' ' HG ' ' A' ' 122' ' ' LEU . 3.7 m-85 -91.85 -35.21 14.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.19 -0.459 . . . . 54.42 110.875 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.248 0 C-N-CA 120.691 -0.766 . . . . 72.22 112.453 179.974 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 3.4 t-105 . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.786 0.327 . . . . 71.22 110.917 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 41.1 mm-40 -71.17 -35.49 71.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.271 -0.422 . . . . 72.51 110.926 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 5.8 mm-40 -68.85 -37.13 78.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.098 -0.501 . . . . 74.32 110.88 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.21 -36.95 71.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.2 -0.454 . . . . 74.22 111.059 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 10.6 tt0 -69.87 -42.96 72.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.21 -0.45 . . . . 73.12 110.931 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 35.6 m-20 -65.21 -31.56 72.79 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.46 . . . . 72.4 110.808 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 17.5 m-85 -70.42 -36.6 74.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.214 -0.448 . . . . 75.11 110.979 -179.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -72.01 -26.32 62.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.063 -0.517 . . . . 75.43 110.923 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 5.0 ptmt -67.6 -32.18 72.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.175 -0.466 . . . . 75.45 110.882 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.8 ptp85 -85.91 -26.74 25.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.251 -0.432 . . . . 74.22 110.82 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -74.51 2.36 9.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.255 -0.429 . . . . 75.2 110.868 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 60.3 t80 . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.154 -0.475 . . . . 74.4 110.947 -179.818 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.423 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 31.1 tp . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.733 0.302 . . . . 74.54 110.861 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -57.64 -46.06 84.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.295 -0.412 . . . . 73.13 110.821 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.56 -36.68 84.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.133 -0.485 . . . . 71.12 111.108 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 11.8 mtmt -70.38 -49.31 50.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.171 -0.468 . . . . 74.43 110.845 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.423 ' HG ' ' O ' ' A' ' 35' ' ' LEU . 5.1 mt -59.79 -35.77 75.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.287 -0.415 . . . . 74.44 110.881 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.1 ttmt -58.15 -46.25 85.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.198 -0.455 . . . . 74.2 110.912 179.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -70.37 -36.4 74.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 75.11 110.869 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.9 ttp -69.4 -36.48 76.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.173 -0.467 . . . . 63.43 110.849 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -66.91 -43.34 83.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.166 -0.47 . . . . 75.32 110.987 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.547 ' HD2' ' N ' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -73.11 -20.83 60.85 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.191 -0.459 . . . . 75.11 110.921 179.886 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.547 ' N ' ' HD2' ' A' ' 44' ' ' LYS . 89.1 t80 -71.22 -37.6 72.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.241 -0.436 . . . . 73.32 110.945 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -81.91 -28.4 32.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.109 -0.496 . . . . 70.43 110.841 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 106.45 -10.44 42.48 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.723 -0.751 . . . . 64.42 112.538 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.401 HD13 HG13 ' A' ' 50' ' ' ILE . 0.9 OUTLIER -63.47 138.61 97.41 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.65 0.738 . . . . 74.31 110.863 -179.858 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.84 -54.04 0.24 Allowed 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.664 2.243 . . . . 74.5 112.38 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.401 HG13 HD13 ' A' ' 48' ' ' LEU . 0.7 OUTLIER -50.08 107.97 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.24 -0.436 . . . . 72.24 111.074 179.931 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 3.6 p -111.0 167.07 10.53 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.197 -0.456 . . . . 73.25 111.174 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 57.68 19.59 35.99 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.739 -0.743 . . . . 64.24 112.538 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.1 mtt -119.55 161.09 21.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.795 0.331 . . . . 75.23 110.883 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.405 ' HA ' ' HB ' ' A' ' 58' ' ' VAL . 26.2 tp -164.35 85.38 0.44 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.27 -0.423 . . . . 74.32 110.99 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 175.52 -29.17 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.188 -0.46 . . . . 61.31 110.86 179.907 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 23.5 m -89.77 -101.29 0.1 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.235 -0.439 . . . . 75.25 110.811 -179.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.79 -28.54 26.09 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.125 -0.489 . . . . 74.13 110.927 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.405 ' HB ' ' HA ' ' A' ' 54' ' ' LEU . 43.6 t -64.63 -42.69 95.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.125 -0.489 . . . . 72.2 111.12 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 1.5 mm -74.61 -31.43 27.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.161 -0.472 . . . . 75.2 111.127 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -58.97 -40.16 83.93 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.15 -0.477 . . . . 73.45 110.913 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.44 HG13 ' N ' ' A' ' 62' ' ' MET . 1.2 pp -68.17 -28.98 42.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.088 -0.505 . . . . 74.52 111.124 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' MET . . . . . 0.44 ' N ' HG13 ' A' ' 61' ' ' ILE . 3.3 mmt -60.54 -40.19 90.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.182 -0.463 . . . . 74.01 110.891 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -84.46 -23.76 29.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.219 -0.446 . . . . 45.15 110.892 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.37 112.1 41.59 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.533 0.682 . . . . 75.32 110.873 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 151.8 69.12 Favored 'Trans proline' 0 N--CA 1.465 -0.188 0 C-N-CA 122.707 2.271 . . . . 72.11 112.367 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -145.75 -68.84 0.28 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.217 -0.447 . . . . 73.22 110.843 -179.939 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -145.21 151.89 39.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.243 -0.435 . . . . 72.31 110.889 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.597 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -88.02 4.27 85.59 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.742 -0.742 . . . . 64.23 112.495 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -92.89 135.24 26.28 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.645 0.735 . . . . 74.23 111.111 -179.912 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 151.93 69.1 Favored 'Trans proline' 0 C--O 1.231 0.143 0 C-N-CA 122.679 2.253 . . . . 63.44 112.321 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -58.91 -30.86 68.13 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.166 -0.47 . . . . 74.45 110.864 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 8.9 m . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.208 -0.451 . . . . 73.52 111.111 -179.957 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 C--O 1.232 0.181 0 CA-C-O 120.855 0.273 . . . . 72.25 112.319 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 20.4 mttp -78.31 161.16 27.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.263 -0.426 . . . . 72.53 110.849 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . 0.425 ' CD1' ' HA ' ' A' ' 200' ' ' LEU . 27.2 m95 -49.88 116.42 1.8 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.217 -0.447 . . . . 73.31 110.906 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 6.4 m -115.17 1.05 13.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.262 -0.427 . . . . 71.34 111.132 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.8 m -66.33 -176.61 0.45 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.197 -0.456 . . . . 73.12 110.842 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 4.0 mttt -92.07 -23.08 19.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.102 -0.499 . . . . 71.12 110.94 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -154.29 143.49 13.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.226 -0.443 . . . . 74.14 111.064 179.866 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 99.6 t -117.81 130.36 72.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.142 -0.481 . . . . 72.25 111.119 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 28.8 p -122.09 162.34 21.42 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.16 -0.473 . . . . 75.51 111.157 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 4.0 p90 -151.24 146.59 26.17 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.223 -0.444 . . . . 70.51 110.932 -179.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 10.4 ttt180 -148.36 135.88 20.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.124 -0.489 . . . . 74.3 110.899 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.413 HD11 ' HA ' ' A' ' 106' ' ' ASP . 3.9 mp -74.82 135.46 27.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.205 -0.452 . . . . 72.4 111.173 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.414 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 19.9 t -90.33 -40.48 12.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.19 -0.459 . . . . 74.41 111.105 179.909 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 40.9 t -144.16 164.45 30.65 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.174 -0.466 . . . . 64.24 110.863 -179.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 6.1 p90 -111.47 153.41 26.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.159 -0.473 . . . . 74.1 110.958 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' THR . . . . . 0.447 ' O ' ' O ' ' A' ' 100' ' ' LEU . 0.2 OUTLIER -82.61 140.97 32.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.128 -0.487 . . . . 75.33 111.136 -179.949 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 10.8 ptp180 -73.21 -7.88 53.38 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.214 -0.448 . . . . 72.14 110.893 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -96.42 -26.05 15.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.232 -0.44 . . . . 74.13 110.927 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.447 ' O ' ' O ' ' A' ' 97' ' ' THR . 0.5 OUTLIER -133.55 153.75 80.44 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.57 0.7 . . . . 72.52 110.928 -179.936 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . 0.425 ' HB2' HG23 ' A' ' 103' ' ' ILE . 54.5 Cg_endo -69.7 150.9 69.16 Favored 'Trans proline' 0 N--CA 1.465 -0.187 0 C-N-CA 122.744 2.296 . . . . 73.11 112.359 179.825 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 16.3 t-160 -53.22 -25.79 15.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.304 -0.407 . . . . 74.11 110.817 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.425 HG23 ' HB2' ' A' ' 101' ' ' PRO . 15.2 tt -76.62 -39.15 31.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.449 . . . . 74.02 111.119 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 3.3 m -69.2 -38.91 78.86 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.166 -0.47 . . . . 54.24 111.157 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 97.3 t -72.72 -44.85 58.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.172 -0.467 . . . . 73.13 111.111 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.603 ' O ' HG21 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -66.27 -41.79 89.39 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.257 -0.429 . . . . 63.44 110.851 179.893 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -70.04 -34.23 72.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 75.02 110.909 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.574 ' HB3' ' HD2' ' A' ' 188' ' ' PHE . 0.0 OUTLIER -61.05 -48.1 83.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.162 -0.472 . . . . 75.05 110.935 -179.991 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.603 HG21 ' O ' ' A' ' 106' ' ' ASP . 1.4 m -55.37 -41.37 61.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.218 -0.446 . . . . 72.31 111.095 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.463 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 32.1 t -70.08 -33.8 72.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.17 -0.468 . . . . 72.14 110.894 -179.807 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.28 -33.26 74.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.09 -0.504 . . . . 74.35 110.873 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -95.68 -40.53 9.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.219 -0.446 . . . . 74.32 111.114 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.424 ' HB2' ' HG ' ' A' ' 196' ' ' LEU . 0.4 OUTLIER -65.32 -32.8 74.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.263 -0.426 . . . . 74.11 110.954 -179.984 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 15.4 t30 -65.49 -39.85 92.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.172 -0.467 . . . . 75.15 110.887 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.85 -34.95 73.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.107 -0.497 . . . . 74.0 110.868 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 28.2 m95 -66.59 -52.28 47.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.282 -0.417 . . . . 75.23 110.947 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -60.13 -36.17 89.79 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.754 -0.736 . . . . 73.44 112.45 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.3 mmpt? -64.67 -14.09 56.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.724 0.297 . . . . 74.42 110.95 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -99.11 -13.81 19.64 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.226 -0.443 . . . . 75.55 110.873 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . 0.422 ' C ' ' H ' ' A' ' 122' ' ' LEU . 6.9 pt -122.79 142.92 38.95 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.619 0.723 . . . . 71.34 111.121 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.8 8.54 0.75 Allowed 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.708 2.272 . . . . 75.35 112.364 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.422 ' H ' ' C ' ' A' ' 120' ' ' ILE . 16.4 mt -61.26 -163.17 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.216 -0.447 . . . . 73.22 110.938 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . 0.407 ' H ' ' HB3' ' A' ' 122' ' ' LEU . 3.3 t60 -144.87 122.98 12.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.196 -0.457 . . . . 74.12 110.861 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 9.2 m-30 -107.49 141.47 38.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 75.54 110.86 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.93 141.63 51.88 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.164 -0.471 . . . . 75.14 110.911 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.85 152.5 28.15 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.263 -0.426 . . . . 74.04 110.876 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . 0.408 HG13 ' CB ' ' A' ' 132' ' ' ALA . 29.3 m -103.17 126.24 57.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.176 -0.466 . . . . 50.13 111.137 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -144.9 -11.08 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.151 -0.477 . . . . 74.43 111.126 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -157.0 109.24 2.46 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.166 -0.47 . . . . 73.32 110.869 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 108.22 -162.49 13.06 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.726 -0.749 . . . . 62.11 112.505 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.88 156.35 17.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.79 0.328 . . . . 71.11 111.132 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . 0.408 ' CB ' HG13 ' A' ' 127' ' ' VAL . . . -111.62 165.28 12.15 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.196 -0.456 . . . . 72.32 111.109 179.852 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -73.41 -55.1 6.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 75.41 110.819 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 4.8 mp -92.68 107.48 19.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.205 -0.452 . . . . 71.04 111.143 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' MET . . . . . 0.414 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 14.0 mmm -91.54 128.18 37.27 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.207 -0.451 . . . . 72.43 110.887 179.849 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -106.13 94.74 3.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.263 -0.426 . . . . 70.04 111.098 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -134.59 160.56 24.27 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.732 -0.747 . . . . 63.34 112.47 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 49.2 m-85 -105.08 149.53 25.76 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.82 0.343 . . . . 74.01 110.912 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . 169.43 166.83 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.203 -0.453 . . . . 71.21 111.074 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -104.44 173.27 6.38 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.189 -0.459 . . . . 72.34 110.928 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -55.36 -17.1 11.2 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.72 -0.753 . . . . 74.24 112.524 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -88.3 12.93 12.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.829 0.347 . . . . 75.03 111.109 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 5.9 p80 -80.67 -22.11 40.73 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.184 -0.462 . . . . 73.45 110.939 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 139.34 38.7 0.1 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.808 -0.71 . . . . 60.43 112.495 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 54.1 p-10 -150.18 152.01 33.98 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.823 0.344 . . . . 72.14 110.869 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 96.0 p -73.4 -179.74 3.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.175 -0.466 . . . . 64.54 110.861 -179.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 68.6 121.08 0.03 OUTLIER Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.659 0.742 . . . . 73.4 110.897 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.75 144.88 55.52 Favored 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 122.665 2.243 . . . . 74.53 112.391 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 149' ' ' PHE . . . . . 0.429 ' CE1' ' HB2' ' A' ' 173' ' ' ASP . 0.1 OUTLIER -90.89 -32.78 15.89 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.182 -0.463 . . . . 70.0 110.926 -179.975 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 73.88 -1.26 3.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.158 -0.474 . . . . 72.24 110.859 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 49.58 -108.37 0.44 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.809 -0.71 . . . . 75.42 112.504 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.84 139.61 40.37 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.58 2.186 . . . . 75.11 112.419 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 103.23 -155.16 18.08 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.745 -0.741 . . . . 70.32 112.497 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 154' ' ' ASN . . . . . 0.436 ' O ' ' CB ' ' A' ' 155' ' ' THR . 2.9 p30 -42.06 153.75 0.06 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.989 0.423 . . . . 74.45 110.857 -179.834 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 155' ' ' THR . . . . . 0.436 ' CB ' ' O ' ' A' ' 154' ' ' ASN . 1.2 m 80.15 114.53 0.06 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.149 -0.478 . . . . 63.14 111.155 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 156' ' ' LEU . . . . . 0.47 HD11 HG13 ' A' ' 186' ' ' ILE . 0.7 OUTLIER -99.72 -51.64 3.68 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.255 -0.43 . . . . 75.02 110.984 179.928 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . 0.597 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -163.4 148.11 11.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.176 -0.465 . . . . 73.44 111.12 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 21.3 p-80 -108.13 124.92 50.98 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.257 -0.428 . . . . 74.34 110.873 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -110.73 156.26 21.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.239 -0.437 . . . . 74.42 111.065 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 13.0 m-30 -117.05 150.89 37.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.208 -0.451 . . . . 75.31 110.864 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -79.87 164.55 52.52 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 121.591 0.71 . . . . 71.14 111.078 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 78.38 1.01 Allowed 'Trans proline' 0 C--N 1.341 0.156 0 C-N-CA 122.707 2.271 . . . . 74.44 112.316 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -140.29 128.55 3.88 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.722 -0.752 . . . . 72.32 112.507 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 64.64 -169.96 0.2 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.848 0.356 . . . . 73.1 111.113 -179.87 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -85.63 -49.86 4.2 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.727 -0.749 . . . . 74.03 112.483 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 8.2 tt -68.14 -27.52 66.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.869 0.366 . . . . 75.02 110.947 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -84.04 159.92 36.34 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.801 -0.714 . . . . 43.43 112.467 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 88.26 23.07 38.69 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.766 -0.731 . . . . 74.31 112.498 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 -101.14 164.4 11.81 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.862 0.363 . . . . 63.41 110.83 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.13 130.44 55.9 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.16 -0.473 . . . . 74.21 111.118 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 21.2 m170 -125.9 158.54 34.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.242 -0.435 . . . . 72.53 110.81 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -139.45 139.09 36.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.176 -0.466 . . . . 71.44 110.898 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 173' ' ' ASP . . . . . 0.429 ' HB2' ' CE1' ' A' ' 149' ' ' PHE . 67.1 t0 -67.65 97.61 0.63 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.165 -0.47 . . . . 74.11 110.863 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.05 -16.05 11.44 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.137 -0.483 . . . . 74.45 110.905 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -79.16 -16.42 56.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.135 -0.484 . . . . 73.32 110.832 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 37.2 mm-40 -83.17 -173.66 4.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.158 -0.474 . . . . 71.41 110.927 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 78.7 mtt180 -110.33 110.92 21.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.222 -0.445 . . . . 74.32 110.935 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 68.1 m95 -110.86 134.39 52.58 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.196 -0.456 . . . . 74.32 110.957 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 7.4 t -177.28 163.62 2.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.225 -0.443 . . . . 74.13 111.077 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -125.22 -70.25 0.75 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.165 -0.471 . . . . 61.52 110.847 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -63.06 -13.42 48.43 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.804 -0.712 . . . . 62.41 112.529 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 182' ' ' SER . . . . . 0.418 ' O ' ' C ' ' A' ' 183' ' ' SER . 0.3 OUTLIER -93.1 -24.44 18.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.885 0.374 . . . . 74.0 110.89 -179.739 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 183' ' ' SER . . . . . 0.418 ' C ' ' O ' ' A' ' 182' ' ' SER . 89.5 p 36.04 58.53 0.95 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 64.12 110.866 -179.814 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -116.85 -33.48 4.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.154 -0.475 . . . . 74.43 110.894 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -119.52 -138.58 5.76 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.713 -0.756 . . . . 74.22 112.491 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 186' ' ' ILE . . . . . 0.47 HG13 HD11 ' A' ' 156' ' ' LEU . 9.2 mm -79.49 102.98 5.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 120.798 0.332 . . . . 73.22 111.115 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -48.96 119.54 3.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.202 -0.454 . . . . 71.31 110.866 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 188' ' ' PHE . . . . . 0.574 ' HD2' ' HB3' ' A' ' 108' ' ' LEU . 1.3 t80 -53.94 -33.72 57.59 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.172 -0.467 . . . . 75.45 110.914 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.1 -47.49 71.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.101 -0.499 . . . . 60.14 110.995 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.42 -42.54 74.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.16 -0.473 . . . . 74.22 110.927 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -68.92 -35.28 76.63 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.125 -0.489 . . . . 61.32 111.124 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 192' ' ' ALA . . . . . 0.448 ' O ' ' HB2' ' A' ' 196' ' ' LEU . . . -56.84 -43.08 80.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.256 -0.429 . . . . 52.32 111.071 179.886 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.65 -41.45 81.47 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.208 -0.451 . . . . 72.43 111.113 -179.851 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 5.3 t-160 -73.34 -45.62 54.06 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.207 -0.451 . . . . 71.44 110.888 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -67.49 -48.91 65.74 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.157 -0.474 . . . . 71.01 111.057 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 196' ' ' LEU . . . . . 0.499 ' N ' HD21 ' A' ' 196' ' ' LEU . 4.2 mm? -66.31 -37.36 85.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.293 -0.412 . . . . 74.52 110.924 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -65.4 -28.49 73.64 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.744 -0.741 . . . . 62.43 112.461 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 198' ' ' HIS . . . . . . . . . . . . . 4.0 m-70 -66.87 -37.9 85.29 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.84 0.352 . . . . 75.21 110.873 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -64.46 -20.92 66.48 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.218 -0.446 . . . . 73.13 110.808 -179.764 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 200' ' ' LEU . . . . . 0.425 ' HA ' ' CD1' ' A' ' 84' ' ' TRP . 0.6 OUTLIER -88.5 0.63 56.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.216 -0.447 . . . . 75.12 110.854 -179.969 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 84.1 -6.34 75.88 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.807 -0.711 . . . . 50.41 112.452 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 202' ' ' MET . . . . . . . . . . . . . 36.5 tpp -50.27 139.27 15.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.877 0.37 . . . . 71.04 110.798 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -103.26 158.98 17.3 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.751 -0.738 . . . . 64.44 112.438 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 27.3 m-70 -58.22 150.96 20.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.784 0.326 . . . . 74.32 110.881 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -116.39 146.87 42.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.261 -0.427 . . . . 72.42 110.814 -179.754 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 88.7 p -87.96 -4.74 58.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.106 -0.497 . . . . 72.22 110.889 -179.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.64 136.47 83.26 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.61 0.719 . . . . 65.11 110.849 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.75 -8.21 23.02 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.681 2.254 . . . . 74.53 112.417 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -122.92 23.02 9.5 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.16 -0.473 . . . . 63.52 110.948 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 210' ' ' ALA . . . . . 0.428 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.25 145.81 26.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.08 -0.509 . . . . 64.4 111.102 179.841 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -69.55 -29.01 39.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.229 -0.441 . . . . 75.23 111.132 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -93.53 10.36 32.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.151 -0.477 . . . . 75.22 110.882 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 213' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -55.56 114.68 7.74 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-O 121.699 0.761 . . . . 73.43 110.958 -179.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 -20.0 35.41 Favored 'Trans proline' 0 C--O 1.232 0.211 0 C-N-CA 122.639 2.226 . . . . 63.01 112.315 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -86.45 49.18 1.75 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.255 -0.43 . . . . 74.24 111.128 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 6.5 t80 . . . . . 0 C--N 1.328 -0.357 0 CA-C-N 116.251 -0.431 . . . . 74.42 110.937 -179.935 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.935 0.398 . . . . 71.11 110.866 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -143.19 163.01 34.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.165 -0.47 . . . . 65.02 110.941 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 14.9 mt -61.77 148.99 41.23 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.276 -0.42 . . . . 62.53 110.968 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 227' ' ' SER . . . . . 0.428 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 0.3 OUTLIER -86.95 148.33 25.38 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.237 -0.438 . . . . 74.21 110.787 -179.836 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -60.5 -68.71 0.27 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.14 -0.482 . . . . 74.54 110.935 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.48 -25.42 36.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.217 -0.447 . . . . 74.2 110.828 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -68.89 -48.31 63.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.196 -0.456 . . . . 74.23 110.86 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 231' ' ' ILE . . . . . . . . . . . . . 8.0 mt -68.55 -42.67 83.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.236 -0.438 . . . . 73.41 111.096 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 14.0 ptmt -64.73 -32.38 74.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.242 -0.435 . . . . 73.32 110.889 179.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -62.9 -50.07 66.96 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.767 -0.73 . . . . 65.45 112.475 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -73.15 -30.5 31.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.862 0.363 . . . . 74.41 111.195 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 15.3 mt-30 -67.13 -24.28 65.9 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.136 -0.483 . . . . 71.13 110.984 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 236' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.09 -26.59 60.45 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.143 -0.481 . . . . 74.41 110.874 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 237' ' ' LEU . . . . . . . . . . . . . 8.1 tt -97.63 -28.94 13.7 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.22 -0.445 . . . . 75.41 110.949 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 238' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -92.11 -35.15 14.05 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.19 -0.459 . . . . 54.42 110.958 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.299 0 C-N-CA 120.756 -0.735 . . . . 72.22 112.504 179.919 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 40.5 t-105 . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.763 0.316 . . . . 71.22 110.92 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -67.61 -35.47 79.02 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.274 -0.421 . . . . 72.51 110.93 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 16.9 mm-40 -65.73 -36.72 84.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.108 -0.496 . . . . 74.32 110.905 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.28 -38.91 74.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.234 -0.439 . . . . 74.22 111.059 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -72.7 -42.98 63.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.212 -0.449 . . . . 73.12 110.867 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . 0.512 ' O ' ' HG3' ' A' ' 20' ' ' LYS . 2.9 m-20 -67.06 -31.49 72.04 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.258 -0.428 . . . . 72.4 110.86 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.471 ' HA ' ' HG2' ' A' ' 21' ' ' ARG . 3.2 m-85 -72.07 -43.07 65.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.153 -0.476 . . . . 75.11 110.914 -179.809 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -73.61 -33.78 64.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.471 . . . . 75.43 110.879 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.512 ' HG3' ' O ' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -73.06 -35.84 66.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.183 -0.462 . . . . 75.45 110.927 179.769 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.471 ' HG2' ' HA ' ' A' ' 18' ' ' TYR . 0.6 OUTLIER -71.5 -27.96 63.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.208 -0.451 . . . . 74.22 110.869 -179.956 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -60.08 -25.28 65.28 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.193 -0.458 . . . . 75.2 110.833 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 116.203 -0.453 . . . . 74.4 110.899 -179.854 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.1 tp . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.797 0.332 . . . . 74.54 110.96 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.3 -51.38 63.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.197 -0.456 . . . . 73.13 110.899 179.865 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.34 -38.91 92.99 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.2 -0.454 . . . . 71.12 111.186 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.451 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 2.3 mmtt -69.34 -42.11 75.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.226 -0.443 . . . . 74.43 110.836 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.403 ' O ' ' HG2' ' A' ' 43' ' ' GLN . 1.7 mp -54.48 -38.71 66.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.317 -0.401 . . . . 74.44 110.922 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -58.69 -45.42 89.51 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.171 -0.468 . . . . 74.2 110.905 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.451 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 1.5 pt-20 -60.67 -32.85 72.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.27 -0.423 . . . . 75.11 110.89 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 9.0 ttt -68.52 -34.1 75.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.113 -0.494 . . . . 63.43 110.884 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.427 ' HG3' ' HA ' ' A' ' 51' ' ' THR . 2.5 mm100 -59.95 -39.42 85.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.209 -0.45 . . . . 75.32 110.935 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.9 mmpt? -71.57 -30.6 66.04 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.163 -0.472 . . . . 75.11 110.895 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -70.46 -43.5 69.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.225 -0.443 . . . . 73.32 110.875 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -82.01 -34.95 29.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.127 -0.488 . . . . 70.43 110.852 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 103.07 -6.97 51.78 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.733 -0.746 . . . . 64.42 112.455 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.85 137.28 90.4 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-O 121.657 0.741 . . . . 74.31 110.911 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.69 -52.23 0.34 Allowed 'Trans proline' 0 C--N 1.343 0.239 0 C-N-CA 122.675 2.25 . . . . 74.5 112.32 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -50.96 108.29 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.206 -0.452 . . . . 72.24 111.186 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.427 ' HA ' ' HG3' ' A' ' 43' ' ' GLN . 3.6 p -99.21 152.48 19.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.18 -0.464 . . . . 73.25 111.197 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 59.2 17.73 39.23 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.761 -0.733 . . . . 64.24 112.472 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 15.2 mmt -102.8 161.04 14.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.828 0.347 . . . . 75.23 110.848 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 29.5 tp -168.54 81.94 0.16 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.186 -0.461 . . . . 74.32 110.854 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 174.5 -28.09 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.227 -0.442 . . . . 61.31 110.936 179.877 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.8 p -87.85 -99.86 0.08 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.121 -0.49 . . . . 75.25 110.843 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 17.4 tpt180 -84.97 -29.16 25.3 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.108 -0.496 . . . . 74.13 110.904 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.485 ' O ' HG13 ' A' ' 61' ' ' ILE . 84.7 t -60.95 -45.04 99.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.225 -0.443 . . . . 72.2 111.126 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 7.6 mm -75.37 -31.66 24.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.202 -0.454 . . . . 75.2 111.111 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.6 -44.1 93.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.196 -0.457 . . . . 73.45 110.886 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.485 HG13 ' O ' ' A' ' 58' ' ' VAL . 1.5 pp -66.82 -29.47 46.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.165 -0.47 . . . . 74.52 111.184 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 8.2 mmt -63.0 -38.67 92.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.161 -0.472 . . . . 74.01 110.844 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -84.49 -25.71 28.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.254 -0.43 . . . . 45.15 110.934 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.42 136.24 37.79 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.547 0.689 . . . . 75.32 110.924 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -69.82 156.84 62.16 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.731 2.287 . . . . 72.11 112.28 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.409 ' HG3' ' HA ' ' A' ' 214' ' ' PRO . 13.1 ttp180 -149.88 -83.89 0.1 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.181 -0.463 . . . . 73.22 110.89 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -145.58 153.9 41.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.181 -0.463 . . . . 72.31 110.893 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.554 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -108.02 24.58 22.83 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.745 -0.74 . . . . 64.23 112.457 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -106.69 134.38 19.85 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 121.629 0.728 . . . . 74.23 111.065 -179.947 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 143.32 50.53 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.717 2.278 . . . . 63.44 112.289 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -102.08 24.52 9.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.233 -0.44 . . . . 74.45 110.878 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 3.9 m . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.221 -0.445 . . . . 73.52 111.13 -179.968 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 C--O 1.231 0.142 0 CA-C-O 120.901 0.292 . . . . 72.25 112.367 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 4.4 mttp -78.82 165.85 23.09 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.217 -0.447 . . . . 72.53 110.91 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . 0.404 ' CD1' ' HA ' ' A' ' 200' ' ' LEU . 52.6 m95 -49.71 137.72 15.49 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.235 -0.439 . . . . 73.31 110.864 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 2.2 t -115.28 -27.14 7.35 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.207 -0.451 . . . . 71.34 111.112 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -53.19 171.41 0.07 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.215 -0.448 . . . . 73.12 110.808 -179.776 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.58 -30.69 20.33 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.133 -0.485 . . . . 71.12 110.905 179.916 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -148.39 140.43 18.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.214 -0.448 . . . . 74.14 111.108 179.888 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 90.4 t -123.35 141.39 43.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.155 -0.475 . . . . 72.25 111.106 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 15.2 p -115.61 155.16 28.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.188 -0.46 . . . . 75.51 111.202 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.435 ' O ' ' CG2' ' A' ' 127' ' ' VAL . 3.9 p90 -137.42 146.61 44.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.265 -0.425 . . . . 70.51 110.911 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 7.7 ttt-85 -150.87 139.09 20.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.123 -0.49 . . . . 74.3 110.9 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.3 mm -75.2 133.97 30.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.197 -0.456 . . . . 72.4 111.099 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.461 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 8.1 t -91.32 -40.63 12.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.162 -0.472 . . . . 74.41 111.114 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -149.05 169.39 20.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.168 -0.469 . . . . 64.24 110.841 -179.818 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 14.8 p90 -132.29 155.01 49.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.161 -0.472 . . . . 74.1 110.925 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.5 t -102.38 141.78 34.66 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.169 -0.469 . . . . 75.33 111.101 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -52.5 -18.7 1.81 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.449 . . . . 72.14 110.863 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -65.08 -37.07 86.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.21 -0.45 . . . . 74.13 110.9 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.5 mp -142.47 152.11 59.46 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.65 0.738 . . . . 72.52 110.899 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . 0.415 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.9 Cg_endo -69.7 150.94 69.26 Favored 'Trans proline' 0 C--N 1.343 0.244 0 C-N-CA 122.637 2.225 . . . . 73.11 112.362 179.879 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -52.19 -27.84 16.1 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.19 -0.459 . . . . 74.11 110.828 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.415 HG22 ' HB2' ' A' ' 101' ' ' PRO . 2.2 tp -75.22 -38.91 42.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.212 -0.449 . . . . 74.02 111.173 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 2.9 m -69.34 -36.84 77.32 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.144 -0.48 . . . . 54.24 111.183 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 55.2 t -71.43 -43.44 72.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.159 -0.473 . . . . 73.13 111.105 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.598 ' O ' HG22 ' A' ' 109' ' ' VAL . 24.9 t0 -66.54 -37.57 85.29 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.123 -0.489 . . . . 63.44 110.881 179.878 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . 0.501 ' HG3' ' N ' ' A' ' 108' ' ' LEU . 0.0 OUTLIER -70.36 -33.38 71.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.248 -0.433 . . . . 75.02 110.829 -179.865 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.517 ' HB3' ' HD1' ' A' ' 188' ' ' PHE . 0.0 OUTLIER -66.11 -48.97 69.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.229 -0.441 . . . . 75.05 110.849 -179.891 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.598 HG22 ' O ' ' A' ' 106' ' ' ASP . 1.4 m -55.13 -43.27 69.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.228 -0.442 . . . . 72.31 111.108 179.82 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.494 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 48.2 t -70.7 -34.33 71.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.149 -0.478 . . . . 72.14 110.867 -179.814 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.56 -33.34 74.74 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.136 -0.483 . . . . 74.35 110.948 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -95.39 -40.49 9.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.254 -0.43 . . . . 74.32 111.108 179.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.54 -32.76 74.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.197 -0.456 . . . . 74.11 110.939 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 42.4 t30 -65.48 -35.29 80.46 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.187 -0.46 . . . . 75.15 110.84 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' MET . . . . . 0.415 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 0.0 OUTLIER -68.31 -34.52 76.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.188 -0.46 . . . . 74.0 110.813 179.992 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' TRP . . . . . 0.406 ' O ' HG12 ' A' ' 120' ' ' ILE . 6.0 m95 -66.99 -44.86 79.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.287 -0.415 . . . . 75.23 111.006 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -73.39 -40.74 47.56 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.73 -0.748 . . . . 73.44 112.45 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . 0.415 ' HG2' ' O ' ' A' ' 115' ' ' MET . 3.8 ptpt -60.75 -18.43 54.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.811 0.338 . . . . 74.42 110.92 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . 0.43 ' HG2' HG12 ' A' ' 231' ' ' ILE . 0.1 OUTLIER -96.87 13.46 28.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.167 -0.47 . . . . 75.55 110.884 179.934 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . 0.406 HG12 ' O ' ' A' ' 116' ' ' TRP . 3.6 pt -147.92 156.0 44.15 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.591 0.71 . . . . 71.34 111.15 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.77 0.27 5.9 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.675 2.25 . . . . 75.35 112.334 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.408 ' HB3' ' H ' ' A' ' 123' ' ' HIS . 12.5 mt -61.18 -157.92 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.229 -0.441 . . . . 73.22 110.909 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . 0.408 ' H ' ' HB3' ' A' ' 122' ' ' LEU . 4.5 t60 -162.66 137.92 6.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.159 -0.473 . . . . 74.12 110.907 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 17.5 m-30 -122.27 142.35 50.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.199 -0.455 . . . . 75.54 110.889 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.26 140.96 48.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.125 -0.489 . . . . 75.14 110.897 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.19 141.62 34.02 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.196 -0.456 . . . . 74.04 110.886 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . 0.435 ' CG2' ' O ' ' A' ' 91' ' ' TYR . 34.4 m -103.0 139.49 23.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.259 -0.428 . . . . 50.13 111.183 179.8 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -155.13 -29.25 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.165 -0.47 . . . . 74.43 111.077 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -133.22 109.19 9.25 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.146 -0.479 . . . . 73.32 110.881 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.46 -160.69 13.94 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.764 -0.732 . . . . 62.11 112.559 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -101.99 155.77 17.96 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.783 0.325 . . . . 71.11 111.16 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -112.14 165.41 12.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.193 -0.458 . . . . 72.32 111.068 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -69.5 -54.67 13.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.204 -0.453 . . . . 75.41 110.931 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 27.8 mt -83.8 132.57 31.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.138 -0.483 . . . . 71.04 111.111 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' MET . . . . . 0.461 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 28.3 mmt -108.81 116.93 32.93 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.158 -0.474 . . . . 72.43 110.932 179.829 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -106.13 88.39 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.251 -0.432 . . . . 70.04 111.124 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . 0.426 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -130.17 169.48 21.11 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.701 -0.762 . . . . 63.34 112.47 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 36.5 m-85 -112.78 145.88 39.8 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.875 0.369 . . . . 74.01 110.874 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . 173.72 166.44 0.18 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.156 -0.475 . . . . 71.21 111.135 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -104.8 172.96 6.51 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.259 -0.428 . . . . 72.34 110.847 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -54.02 -21.53 17.7 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.69 -0.766 . . . . 74.24 112.476 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -67.08 -12.07 58.9 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.812 0.339 . . . . 75.03 111.092 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 2.0 p80 -68.92 -11.6 60.79 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.252 -0.431 . . . . 73.45 110.855 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 117.68 36.57 0.97 Allowed Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.723 -0.751 . . . . 60.43 112.5 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -120.91 139.97 52.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.76 0.315 . . . . 72.14 110.937 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.23 161.76 18.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.451 . . . . 64.54 110.842 -179.7 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 11.9 m-85 64.71 133.52 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.649 0.738 . . . . 73.4 110.91 -179.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.79 134.81 28.82 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.621 2.214 . . . . 74.53 112.336 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -73.59 -33.1 64.45 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.207 -0.451 . . . . 70.0 110.851 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 74.57 -2.5 2.8 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.186 -0.461 . . . . 72.24 110.9 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 49.5 -108.72 0.49 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.706 -0.759 . . . . 75.42 112.531 -179.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.87 139.02 38.83 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.627 2.218 . . . . 75.11 112.325 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 103.21 -153.28 18.09 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.752 -0.737 . . . . 70.32 112.425 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -41.87 155.1 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.898 0.38 . . . . 74.45 110.894 -179.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 75.31 108.78 0.07 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.132 -0.485 . . . . 63.14 111.158 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 156' ' ' LEU . . . . . 0.457 HD11 HG13 ' A' ' 186' ' ' ILE . 0.5 OUTLIER -90.53 -53.67 4.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.177 -0.465 . . . . 75.02 110.866 -179.98 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . 0.554 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -165.42 148.37 7.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.185 -0.461 . . . . 73.44 111.149 179.823 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 24.0 p-80 -106.13 126.53 52.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.245 -0.434 . . . . 74.34 110.84 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -110.91 160.9 16.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.155 -0.475 . . . . 74.42 111.061 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 13.6 m-85 -111.68 156.96 21.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.215 -0.448 . . . . 75.31 110.913 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -87.79 164.09 35.62 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 121.586 0.708 . . . . 71.14 111.155 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.71 81.8 0.78 Allowed 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.755 2.304 . . . . 74.44 112.37 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -146.7 128.8 3.11 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.727 -0.749 . . . . 72.32 112.448 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 63.9 -172.36 0.17 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.8 0.333 . . . . 73.1 111.174 -179.864 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -87.41 -41.51 6.49 Favored Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.736 -0.745 . . . . 74.03 112.409 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 8.8 tt -71.4 -32.78 68.82 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.84 0.352 . . . . 75.02 110.85 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -79.35 172.45 55.11 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.665 -0.778 . . . . 43.43 112.467 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 78.03 23.08 67.13 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.679 -0.772 . . . . 74.31 112.479 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 95.2 m-20 -97.23 167.49 11.0 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.892 0.377 . . . . 63.41 110.837 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.91 130.34 56.15 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.151 -0.477 . . . . 74.21 111.096 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 16.2 m170 -127.24 132.91 50.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.221 -0.445 . . . . 72.53 110.791 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 172' ' ' PHE . . . . . 0.451 ' HA ' ' HB3' ' A' ' 157' ' ' ALA . 41.9 m-85 -116.86 139.59 50.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.171 -0.468 . . . . 71.44 110.904 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 65.4 t0 -69.38 97.18 0.95 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.151 -0.477 . . . . 74.11 110.861 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.97 -16.66 7.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.166 -0.47 . . . . 74.45 110.85 -179.858 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -79.48 -19.66 49.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.14 -0.482 . . . . 73.32 110.811 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -78.81 -174.87 4.17 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.237 -0.438 . . . . 71.41 110.932 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 177' ' ' ARG . . . . . 0.421 ' HG3' ' HA3' ' A' ' 185' ' ' GLY . 1.4 ptm180 -116.54 116.74 28.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.222 -0.444 . . . . 74.32 110.831 -179.874 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 21.4 m95 -117.11 148.14 41.8 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.142 -0.481 . . . . 74.32 110.856 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 7.5 t 179.16 163.65 0.87 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.206 -0.452 . . . . 74.13 111.167 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -128.35 -68.26 0.77 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.171 -0.468 . . . . 61.52 110.87 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -60.34 -15.16 37.14 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.672 -0.775 . . . . 62.41 112.536 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -97.51 -24.33 15.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.865 0.364 . . . . 74.0 110.862 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 66.7 m 37.84 56.42 1.56 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.158 -0.474 . . . . 64.12 110.821 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 1.3 tp -116.9 -33.2 4.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.102 -0.499 . . . . 74.43 110.867 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 185' ' ' GLY . . . . . 0.421 ' HA3' ' HG3' ' A' ' 177' ' ' ARG . . . -114.37 -142.25 7.93 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.756 -0.735 . . . . 74.22 112.52 179.912 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 186' ' ' ILE . . . . . 0.457 HG13 HD11 ' A' ' 156' ' ' LEU . 11.1 mm -79.07 97.71 2.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.81 0.338 . . . . 73.22 111.125 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -45.53 117.21 1.36 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.199 -0.455 . . . . 71.31 110.815 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 188' ' ' PHE . . . . . 0.517 ' HD1' ' HB3' ' A' ' 108' ' ' LEU . 1.7 t80 -54.09 -36.91 63.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.106 -0.497 . . . . 75.45 110.868 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . 0.401 HD22 HD12 ' A' ' 108' ' ' LEU . 0.0 OUTLIER -67.21 -47.33 71.2 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.135 -0.484 . . . . 60.14 110.886 -179.94 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -68.93 -41.43 78.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.177 -0.465 . . . . 74.22 110.953 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -69.11 -35.19 76.16 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.138 -0.483 . . . . 61.32 111.062 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 192' ' ' ALA . . . . . 0.463 ' O ' ' HB2' ' A' ' 196' ' ' LEU . . . -57.26 -44.05 83.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.225 -0.443 . . . . 52.32 111.034 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.08 -43.49 87.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.226 -0.443 . . . . 72.43 111.169 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 17.6 t-160 -73.12 -42.06 63.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.206 -0.452 . . . . 71.44 110.82 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -70.12 -47.53 61.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.206 -0.452 . . . . 71.01 111.114 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 196' ' ' LEU . . . . . 0.488 ' N ' HD21 ' A' ' 196' ' ' LEU . 4.5 mm? -64.54 -37.94 89.3 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.192 -0.458 . . . . 74.52 110.901 -179.947 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -60.97 -27.29 66.82 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.757 -0.735 . . . . 62.43 112.501 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 198' ' ' HIS . . . . . . . . . . . . . 6.5 m-70 -67.98 -35.69 78.76 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.732 0.301 . . . . 75.21 110.799 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.96 -20.88 65.1 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.282 -0.417 . . . . 73.13 110.837 -179.764 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 200' ' ' LEU . . . . . 0.448 ' HB2' ' HG2' ' A' ' 202' ' ' MET . 0.5 OUTLIER -88.02 -0.04 56.53 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.175 -0.466 . . . . 75.12 110.926 -179.992 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 83.97 5.53 87.65 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.723 -0.751 . . . . 50.41 112.533 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 202' ' ' MET . . . . . 0.448 ' HG2' ' HB2' ' A' ' 200' ' ' LEU . 97.7 mmm -62.73 173.11 1.39 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.781 0.324 . . . . 71.04 110.907 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -137.16 169.19 24.08 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.779 -0.724 . . . . 64.44 112.535 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 20.5 m-70 -66.84 151.49 47.41 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.768 0.318 . . . . 74.32 110.857 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -118.99 146.06 45.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.222 -0.445 . . . . 72.42 110.835 -179.771 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 3.6 m -87.86 -4.19 58.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.104 -0.498 . . . . 72.22 110.899 -179.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 207' ' ' ASP . . . . . 0.419 ' O ' ' CD1' ' A' ' 213' ' ' TYR . 0.1 OUTLIER -71.33 142.87 87.36 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.571 0.701 . . . . 65.11 110.874 179.916 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.68 -29.96 23.43 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.658 2.238 . . . . 74.53 112.405 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 3.1 p-10 -105.57 25.36 10.85 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.214 -0.448 . . . . 63.52 110.845 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 210' ' ' ALA . . . . . 0.453 ' O ' ' HB2' ' A' ' 213' ' ' TYR . . . -87.31 146.3 25.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.22 -0.445 . . . . 64.4 111.096 179.814 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 211' ' ' VAL . . . . . 0.531 HG12 ' HG3' ' A' ' 212' ' ' MET . 0.4 OUTLIER -73.59 -26.61 22.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.187 -0.46 . . . . 75.23 111.145 179.974 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 212' ' ' MET . . . . . 0.531 ' HG3' HG12 ' A' ' 211' ' ' VAL . 0.0 OUTLIER -87.86 9.87 20.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.12 -0.491 . . . . 75.22 110.87 179.932 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 213' ' ' TYR . . . . . 0.453 ' HB2' ' O ' ' A' ' 210' ' ' ALA . 0.4 OUTLIER -54.93 120.16 27.01 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.676 0.751 . . . . 73.43 110.88 -179.851 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 214' ' ' PRO . . . . . 0.409 ' HA ' ' HG3' ' A' ' 66' ' ' ARG . 53.4 Cg_endo -69.75 -17.97 37.33 Favored 'Trans proline' 0 C--N 1.342 0.184 0 C-N-CA 122.604 2.203 . . . . 63.01 112.374 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -84.26 -2.4 56.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.18 -0.464 . . . . 74.24 111.2 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 1.5 t80 . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.173 -0.467 . . . . 74.42 110.954 -179.88 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.15 0 CA-C-O 120.87 0.367 . . . . 71.11 110.915 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -143.8 160.55 40.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.455 . . . . 65.02 110.937 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 226' ' ' LEU . . . . . 0.415 HD11 ' HG2' ' A' ' 119' ' ' GLU . 6.6 mt -63.81 149.53 46.71 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.227 -0.442 . . . . 62.53 110.885 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 227' ' ' SER . . . . . . . . . . . . . 1.3 t -86.68 152.01 22.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.208 -0.451 . . . . 74.21 110.895 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 10.7 tt0 -64.4 -66.02 0.6 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.164 -0.471 . . . . 74.54 110.927 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 229' ' ' ASP . . . . . 0.417 ' O ' ' HG3' ' A' ' 232' ' ' LYS . 0.2 OUTLIER -56.08 -25.58 45.91 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.185 -0.462 . . . . 74.2 110.844 179.979 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -69.69 -48.7 58.74 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.205 -0.452 . . . . 74.23 110.855 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 231' ' ' ILE . . . . . 0.43 HG12 ' HG2' ' A' ' 119' ' ' GLU . 9.2 mt -68.83 -41.58 82.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.152 -0.476 . . . . 73.41 111.12 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 232' ' ' LYS . . . . . 0.425 ' HG3' ' N ' ' A' ' 233' ' ' GLY . 0.0 OUTLIER -56.67 -32.06 65.03 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.167 -0.47 . . . . 73.32 110.89 179.855 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 233' ' ' GLY . . . . . 0.425 ' N ' ' HG3' ' A' ' 232' ' ' LYS . . . -64.95 -49.94 60.45 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.731 -0.747 . . . . 65.45 112.464 179.942 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 7.9 tt -72.84 -30.56 33.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.776 0.322 . . . . 74.41 111.173 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 13.0 mt-30 -69.72 -24.31 63.54 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.13 -0.486 . . . . 71.13 110.908 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 236' ' ' LYS . . . . . 0.462 ' HE2' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -73.81 -26.68 60.74 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.148 -0.478 . . . . 74.41 110.909 179.937 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 237' ' ' LEU . . . . . 0.462 ' HB2' ' HE2' ' A' ' 236' ' ' LYS . 10.3 tt -97.42 -36.17 10.44 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.223 -0.444 . . . . 75.41 110.931 179.911 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 238' ' ' TYR . . . . . . . . . . . . . 54.2 m-85 -92.12 -5.28 53.01 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.181 -0.463 . . . . 54.42 110.877 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.296 0 C-N-CA 120.778 -0.725 . . . . 72.22 112.435 -179.97 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 30.8 t-105 . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.726 0.298 . . . . 71.22 110.895 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -68.49 -35.2 77.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.292 -0.413 . . . . 72.51 110.911 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -62.92 -36.52 83.65 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.151 -0.477 . . . . 74.32 110.949 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.01 -42.95 81.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.169 -0.469 . . . . 74.22 111.075 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 11.1 tt0 -70.45 -42.98 70.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.259 -0.428 . . . . 73.12 110.911 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -65.8 -31.53 72.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.141 -0.482 . . . . 72.4 110.88 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -62.26 -36.1 80.99 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.185 -0.461 . . . . 75.11 110.873 -179.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.0 mt -70.43 -21.07 62.86 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.127 -0.488 . . . . 75.43 110.935 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 4.6 ptmt -74.59 -31.21 61.97 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.216 -0.447 . . . . 75.45 110.909 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.4 ptp180 -86.65 -27.45 23.78 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.227 -0.442 . . . . 74.22 110.89 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -60.78 -13.06 12.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 75.2 110.835 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.131 -0.486 . . . . 74.4 110.959 -179.899 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.3 tt . . . . . 0 N--CA 1.46 0.049 0 CA-C-O 120.755 0.312 . . . . 74.54 110.887 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.72 -48.37 74.9 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.191 -0.458 . . . . 73.13 110.92 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.28 -48.52 76.45 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.128 -0.487 . . . . 71.12 111.136 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.9 -38.64 83.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.234 -0.439 . . . . 74.43 110.856 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.1 mp -54.58 -36.59 64.56 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.242 -0.435 . . . . 74.44 110.859 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.35 -45.68 87.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.173 -0.467 . . . . 74.2 110.907 179.836 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -69.7 -34.81 74.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.211 -0.45 . . . . 75.11 110.917 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.51 -47.04 68.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.107 -0.497 . . . . 63.43 110.909 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -58.57 -44.24 89.7 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.246 -0.434 . . . . 75.32 110.869 -179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.5 mmpt? -68.26 -29.99 68.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.175 -0.466 . . . . 75.11 110.904 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 30.0 t80 -69.98 -35.39 74.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.182 -0.463 . . . . 73.32 110.903 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -79.57 -29.77 41.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.162 -0.472 . . . . 70.43 110.825 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . 0.42 ' HA2' ' HB2' ' A' ' 206' ' ' SER . . . 104.74 -10.56 49.1 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.694 -0.765 . . . . 64.42 112.536 -179.921 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.41 HD13 HG13 ' A' ' 50' ' ' ILE . 0.8 OUTLIER -67.27 139.34 94.8 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.683 0.754 . . . . 74.31 110.865 -179.86 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.71 -52.69 0.31 Allowed 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.705 2.27 . . . . 74.5 112.351 179.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.41 HG13 HD13 ' A' ' 48' ' ' LEU . 0.6 OUTLIER -49.24 108.1 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.212 -0.449 . . . . 72.24 111.133 179.939 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 1.5 t -107.01 163.68 12.77 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.198 -0.456 . . . . 73.25 111.131 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 60.82 17.02 49.06 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.747 -0.74 . . . . 64.24 112.465 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -114.13 161.13 18.16 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.852 0.358 . . . . 75.23 110.899 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 55.5 tp -173.29 85.1 0.05 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.23 -0.441 . . . . 74.32 110.929 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 172.44 -27.1 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.241 -0.436 . . . . 61.31 110.917 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 2.5 p -88.8 -97.14 0.09 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.224 -0.444 . . . . 75.25 110.875 -179.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.6 tpt180 -85.04 -32.38 22.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.146 -0.479 . . . . 74.13 110.89 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 69.1 t -60.14 -45.47 95.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.225 -0.443 . . . . 72.2 111.166 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -69.73 -31.32 48.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.168 -0.469 . . . . 75.2 111.113 179.881 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -59.36 -34.15 72.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.227 -0.442 . . . . 73.45 110.917 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -78.52 -30.03 15.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.108 -0.496 . . . . 74.52 111.121 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 5.2 mtt -63.11 -38.23 90.36 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.117 -0.492 . . . . 74.01 110.908 179.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -82.27 -23.14 35.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.147 -0.479 . . . . 45.15 110.927 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 27.5 mttm -85.34 140.77 36.5 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.638 0.732 . . . . 75.32 110.837 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.82 157.69 59.41 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.632 2.221 . . . . 72.11 112.361 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 34.5 ttp180 -155.18 -82.24 0.07 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.255 -0.429 . . . . 73.22 110.825 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -145.14 156.26 43.78 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.229 -0.441 . . . . 72.31 110.847 -179.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.556 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -101.31 17.55 55.43 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.814 -0.708 . . . . 64.23 112.571 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.403 ' CG1' ' HD2' ' A' ' 70' ' ' PRO . 0.0 OUTLIER -109.19 143.49 27.79 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 121.732 0.777 . . . . 74.23 111.101 -179.95 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . 0.403 ' HD2' ' CG1' ' A' ' 69' ' ' VAL . 53.2 Cg_endo -69.82 163.76 37.1 Favored 'Trans proline' 0 C--N 1.342 0.237 0 C-N-CA 122.713 2.275 . . . . 63.44 112.274 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 54.6 m-20 -112.53 33.79 4.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.152 -0.476 . . . . 74.45 110.822 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 1.8 m . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.224 -0.443 . . . . 73.52 111.229 179.956 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo . . . . . 0 N--CA 1.465 -0.171 0 CA-C-O 120.866 0.277 . . . . 72.25 112.382 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -119.8 -168.07 1.54 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.226 -0.443 . . . . 72.53 110.903 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 58.1 m95 -76.14 140.01 41.56 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.205 -0.452 . . . . 73.31 110.887 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 11.4 t -114.67 -23.64 9.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.224 -0.443 . . . . 71.34 111.147 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -55.05 150.29 10.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.25 -0.432 . . . . 73.12 110.84 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 35.9 mmtt -64.86 -29.81 70.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.105 -0.498 . . . . 71.12 110.898 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -148.63 138.15 15.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 74.14 111.147 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 85.1 t -114.91 130.45 69.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.454 . . . . 72.25 111.118 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 28.6 p -115.91 168.09 10.37 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.155 -0.475 . . . . 75.51 111.125 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 4.2 p90 -146.48 146.78 30.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.163 -0.471 . . . . 70.51 110.888 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 4.4 ttt180 -149.0 138.11 21.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.113 -0.494 . . . . 74.3 110.884 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.3 mm -76.48 135.3 27.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.223 -0.444 . . . . 72.4 111.147 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.484 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 17.9 t -91.14 -40.36 12.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.184 -0.462 . . . . 74.41 111.143 179.819 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 25.9 p -142.22 169.49 17.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.127 -0.488 . . . . 64.24 110.855 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 5.2 p90 -115.14 150.74 35.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.124 -0.489 . . . . 74.1 110.889 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' THR . . . . . 0.456 ' O ' ' O ' ' A' ' 100' ' ' LEU . 0.2 OUTLIER -83.05 141.05 32.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.083 -0.508 . . . . 75.33 111.139 -179.996 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 3.7 mtt-85 -73.0 -8.28 55.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.215 -0.448 . . . . 72.14 110.908 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -96.53 -26.0 15.43 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.148 -0.478 . . . . 74.13 110.893 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.456 ' O ' ' O ' ' A' ' 97' ' ' THR . 0.8 OUTLIER -135.91 153.51 77.11 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.676 0.75 . . . . 72.52 110.882 -179.904 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . 0.417 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.5 Cg_endo -69.76 150.91 68.82 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.684 2.256 . . . . 73.11 112.309 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 6.4 t-160 -53.34 -25.55 15.62 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.102 -0.499 . . . . 74.11 110.852 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.417 HG22 ' HB2' ' A' ' 101' ' ' PRO . 13.2 tt -76.54 -38.37 31.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.239 -0.437 . . . . 74.02 111.13 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 2.9 m -69.14 -40.59 78.15 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.193 -0.458 . . . . 54.24 111.161 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 55.9 t -72.92 -46.06 53.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 73.13 111.146 179.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.598 ' O ' HG22 ' A' ' 109' ' ' VAL . 60.5 t0 -61.5 -44.9 96.24 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.142 -0.481 . . . . 63.44 110.94 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -70.03 -33.41 71.95 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.161 -0.472 . . . . 75.02 110.87 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.532 ' HB3' ' HD2' ' A' ' 188' ' ' PHE . 0.0 OUTLIER -60.26 -49.27 78.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.451 . . . . 75.05 110.926 -179.94 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.598 HG22 ' O ' ' A' ' 106' ' ' ASP . 1.5 m -55.3 -42.05 64.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.206 -0.452 . . . . 72.31 111.18 179.79 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.469 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 43.2 t -70.22 -33.45 71.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.138 -0.483 . . . . 72.14 110.804 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -61.46 -33.05 73.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.15 -0.477 . . . . 74.35 110.853 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.75 -40.15 9.11 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.262 -0.426 . . . . 74.32 111.135 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.98 -33.63 76.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.216 -0.447 . . . . 74.11 110.891 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -65.6 -35.65 81.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.205 -0.452 . . . . 75.15 110.925 179.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' MET . . . . . 0.456 ' O ' ' HG3' ' A' ' 118' ' ' LYS . 0.0 OUTLIER -66.3 -31.95 73.07 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.13 -0.487 . . . . 74.0 110.913 179.892 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' TRP . . . . . 0.414 ' O ' HG12 ' A' ' 120' ' ' ILE . 8.7 m95 -73.98 -45.22 51.45 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.27 -0.423 . . . . 75.23 110.861 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -66.05 -44.75 90.8 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.775 -0.726 . . . . 73.44 112.464 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . 0.456 ' HG3' ' O ' ' A' ' 115' ' ' MET . 0.0 OUTLIER -61.97 -17.38 56.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.702 0.287 . . . . 74.42 110.865 -179.943 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . 0.446 ' HB3' HG21 ' A' ' 231' ' ' ILE . 34.5 mm-40 -91.32 2.26 56.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.244 -0.435 . . . . 75.55 110.847 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . 0.414 HG12 ' O ' ' A' ' 116' ' ' TRP . 6.0 pt -139.29 150.61 64.9 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.659 0.743 . . . . 71.34 111.094 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 6.35 1.34 Allowed 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.699 2.266 . . . . 75.35 112.43 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.426 ' HB3' ' H ' ' A' ' 123' ' ' HIS . 11.3 mt -60.96 -161.11 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.129 -0.487 . . . . 73.22 110.986 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . 0.426 ' H ' ' HB3' ' A' ' 122' ' ' LEU . 3.5 t60 -151.03 122.48 7.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.24 -0.436 . . . . 74.12 110.858 179.893 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 10.6 m-30 -109.51 148.41 31.25 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.173 -0.467 . . . . 75.54 110.899 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.14 141.9 48.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.117 -0.492 . . . . 75.14 110.848 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.8 147.58 30.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.152 -0.476 . . . . 74.04 110.934 -179.977 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 30.1 m -103.25 126.29 57.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.26 -0.427 . . . . 50.13 111.162 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -142.52 -9.89 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.205 -0.452 . . . . 74.43 111.154 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -155.75 109.08 2.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.116 -0.493 . . . . 73.32 110.87 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.15 -159.96 14.38 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.748 -0.739 . . . . 62.11 112.502 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.8 156.21 17.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.842 0.354 . . . . 71.11 111.116 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -111.83 165.1 12.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.191 -0.459 . . . . 72.32 111.081 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -67.66 -55.8 11.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.231 -0.441 . . . . 75.41 110.885 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 31.6 mt -92.4 133.04 35.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.223 -0.444 . . . . 71.04 111.167 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' MET . . . . . 0.484 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 14.7 mmm -111.23 124.48 52.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.226 -0.443 . . . . 72.43 110.875 179.821 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -107.06 91.22 1.7 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.147 -0.479 . . . . 70.04 111.107 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -132.38 164.25 23.9 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.736 -0.745 . . . . 63.34 112.507 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 46.2 m-85 -105.67 144.28 32.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.793 0.33 . . . . 74.01 110.86 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . 175.15 167.03 0.3 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.143 -0.48 . . . . 71.21 111.033 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 20.8 mtm105 -104.36 173.62 6.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.192 -0.458 . . . . 72.34 110.88 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -56.06 -17.1 15.47 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.734 -0.746 . . . . 74.24 112.547 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -83.5 3.48 32.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.812 0.339 . . . . 75.03 111.118 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 7.2 p80 -69.85 -30.39 67.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.236 -0.438 . . . . 73.45 110.848 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 144.51 41.03 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.747 -0.74 . . . . 60.43 112.462 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 55.4 p-10 -146.64 162.22 38.91 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.839 0.352 . . . . 72.14 110.89 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 51.0 m -81.65 -179.9 7.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.151 -0.477 . . . . 64.54 110.888 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 64.65 123.68 0.02 OUTLIER Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.684 0.754 . . . . 73.4 110.937 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.83 146.19 58.98 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.717 2.278 . . . . 74.53 112.344 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 149' ' ' PHE . . . . . 0.415 ' CE1' ' HB2' ' A' ' 173' ' ' ASP . 0.1 OUTLIER -90.81 -33.19 15.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.21 -0.45 . . . . 70.0 110.882 -179.952 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 73.87 -1.76 2.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.111 -0.495 . . . . 72.24 110.847 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 51.88 -111.83 1.64 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.762 -0.732 . . . . 75.42 112.459 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.82 139.59 40.39 Favored 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.68 2.254 . . . . 75.11 112.333 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 103.14 -153.14 18.12 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.757 -0.735 . . . . 70.32 112.452 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 154' ' ' ASN . . . . . 0.415 ' O ' ' CB ' ' A' ' 155' ' ' THR . 4.6 p30 -40.81 152.04 0.05 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.913 0.387 . . . . 74.45 110.891 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 155' ' ' THR . . . . . 0.415 ' CB ' ' O ' ' A' ' 154' ' ' ASN . 1.4 m 78.34 110.81 0.07 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.189 -0.46 . . . . 63.14 111.112 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 156' ' ' LEU . . . . . 0.45 HD13 HG13 ' A' ' 186' ' ' ILE . 0.7 OUTLIER -92.25 -52.57 4.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.223 -0.444 . . . . 75.02 110.892 179.959 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . 0.556 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -166.81 148.12 6.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.246 -0.434 . . . . 73.44 111.087 179.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 24.6 p-80 -106.46 125.58 51.17 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.254 -0.43 . . . . 74.34 110.888 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -111.0 154.82 23.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 74.42 111.079 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 18.1 m-85 -104.21 150.09 24.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.183 -0.462 . . . . 75.31 110.842 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -77.67 162.64 67.47 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 121.573 0.701 . . . . 71.14 111.122 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.68 77.51 1.04 Allowed 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.658 2.239 . . . . 74.44 112.369 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -132.56 124.71 3.94 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.736 -0.745 . . . . 72.32 112.441 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 9.6 p 50.95 -170.72 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.856 0.36 . . . . 73.1 111.172 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -76.1 -57.51 4.0 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.775 -0.726 . . . . 74.03 112.479 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 7.7 tt -54.37 -39.69 67.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.853 0.358 . . . . 75.02 110.927 -179.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -81.01 153.63 34.43 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.693 -0.765 . . . . 43.43 112.446 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 95.12 23.02 21.19 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.747 -0.739 . . . . 74.31 112.537 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 82.4 m-20 -92.14 173.29 7.9 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.825 0.345 . . . . 63.41 110.88 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -118.2 130.63 56.2 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.166 -0.47 . . . . 74.21 111.114 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 16.8 m170 -128.66 132.58 48.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.207 -0.451 . . . . 72.53 110.924 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 172' ' ' PHE . . . . . 0.406 ' HA ' ' HB2' ' A' ' 157' ' ' ALA . 42.9 m-85 -116.35 140.16 49.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.253 -0.431 . . . . 71.44 110.902 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 173' ' ' ASP . . . . . 0.415 ' HB2' ' CE1' ' A' ' 149' ' ' PHE . 68.0 t0 -69.22 96.85 0.87 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.117 -0.492 . . . . 74.11 110.778 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 2.6 pp20? -56.42 -17.95 9.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.222 -0.445 . . . . 74.45 110.886 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -79.55 -20.46 47.04 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.117 -0.492 . . . . 73.32 110.944 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 30.0 mm-40 -77.88 -172.4 2.66 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.16 -0.473 . . . . 71.41 110.926 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 20.2 ptt180 -115.03 115.28 26.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.172 -0.467 . . . . 74.32 110.841 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 53.6 m95 -116.95 142.9 46.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.155 -0.475 . . . . 74.32 110.898 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 12.2 t -178.16 163.61 1.71 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.252 -0.431 . . . . 74.13 111.156 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -125.28 -68.9 0.82 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.209 -0.45 . . . . 61.52 110.896 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -63.99 -12.99 51.35 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.762 -0.732 . . . . 62.41 112.515 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -93.34 -24.41 18.12 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.852 0.358 . . . . 74.0 110.81 -179.712 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 86.9 p 38.27 42.96 0.56 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.185 -0.461 . . . . 64.12 110.839 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 2.3 tt -106.92 -33.42 7.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.126 -0.488 . . . . 74.43 110.913 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -113.11 -145.46 9.38 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.69 -0.767 . . . . 74.22 112.428 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 186' ' ' ILE . . . . . 0.45 HG13 HD13 ' A' ' 156' ' ' LEU . 10.6 mm -78.93 97.77 2.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.875 0.369 . . . . 73.22 111.11 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -44.23 115.21 0.8 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.178 -0.464 . . . . 71.31 110.85 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 188' ' ' PHE . . . . . 0.532 ' HD2' ' HB3' ' A' ' 108' ' ' LEU . 1.4 t80 -53.88 -33.64 57.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.199 -0.455 . . . . 75.45 110.912 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.07 -48.25 68.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.098 -0.501 . . . . 60.14 110.922 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.23 -39.77 74.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.151 -0.477 . . . . 74.22 110.938 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -69.87 -34.9 74.18 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.171 -0.468 . . . . 61.32 111.047 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 192' ' ' ALA . . . . . 0.445 ' O ' ' HB2' ' A' ' 196' ' ' LEU . . . -56.38 -44.61 80.36 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.247 -0.433 . . . . 52.32 111.1 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.77 -43.62 90.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 72.43 111.182 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 15.7 t-160 -72.9 -38.0 67.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.218 -0.446 . . . . 71.44 110.872 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -74.63 -47.38 32.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.201 -0.454 . . . . 71.01 111.117 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 196' ' ' LEU . . . . . 0.47 HD22 ' N ' ' A' ' 196' ' ' LEU . 4.6 mm? -63.08 -45.78 90.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.259 -0.428 . . . . 74.52 110.906 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -54.86 -29.47 50.67 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.731 -0.747 . . . . 62.43 112.506 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 198' ' ' HIS . . . . . . . . . . . . . 6.4 m-70 -66.6 -35.89 81.28 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.887 0.375 . . . . 75.21 110.889 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 13.0 t -68.05 -21.28 65.01 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.171 -0.468 . . . . 73.13 110.877 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -89.55 -7.45 54.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.141 -0.481 . . . . 75.12 110.881 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 89.73 9.58 66.12 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.715 -0.755 . . . . 50.41 112.459 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 202' ' ' MET . . . . . . . . . . . . . 18.1 tpp -72.85 135.08 45.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.797 0.332 . . . . 71.04 110.92 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -101.34 159.11 18.71 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.799 -0.715 . . . . 64.44 112.453 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 11.2 m170 -54.77 163.04 1.04 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.736 0.303 . . . . 74.32 110.895 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -124.39 153.93 41.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.255 -0.429 . . . . 72.42 110.912 -179.878 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 206' ' ' SER . . . . . 0.42 ' HB2' ' HA2' ' A' ' 47' ' ' GLY . 7.9 p -88.2 -4.68 58.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.09 -0.504 . . . . 72.22 110.87 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.55 137.51 83.39 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.535 0.683 . . . . 65.11 110.882 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.74 -7.38 20.9 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.628 2.218 . . . . 74.53 112.383 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -125.48 29.32 6.04 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.132 -0.485 . . . . 63.52 110.867 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 210' ' ' ALA . . . . . 0.462 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.24 145.38 26.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.183 -0.462 . . . . 64.4 111.14 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -73.47 -25.14 20.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.218 -0.446 . . . . 75.23 111.143 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 35.3 mmm -95.24 9.52 39.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.451 . . . . 75.22 110.826 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 213' ' ' TYR . . . . . 0.414 ' HB2' ' O ' ' A' ' 210' ' ' ALA . 0.2 OUTLIER -55.59 126.7 64.65 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-O 121.633 0.73 . . . . 73.43 110.926 -179.895 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 214' ' ' PRO . . . . . 0.408 ' HD2' ' CD1' ' A' ' 213' ' ' TYR . 54.1 Cg_endo -69.69 -18.54 37.3 Favored 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.69 2.26 . . . . 63.01 112.313 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 18.6 p -99.85 66.97 1.42 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.213 -0.449 . . . . 74.24 111.052 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 116.222 -0.445 . . . . 74.42 110.877 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.969 0.414 . . . . 71.11 110.855 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.7 -170.8 3.39 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.124 -0.489 . . . . 65.02 110.931 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 226' ' ' LEU . . . . . 0.423 ' HG ' ' HG3' ' A' ' 119' ' ' GLU . 0.9 OUTLIER -59.18 148.93 29.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.258 -0.428 . . . . 62.53 110.922 179.885 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 227' ' ' SER . . . . . 0.462 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 1.9 t -86.73 156.31 20.0 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.14 -0.482 . . . . 74.21 110.889 -179.936 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.71 -63.5 1.24 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.178 -0.464 . . . . 74.54 110.948 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 49.3 t0 -55.66 -27.47 50.16 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.233 -0.44 . . . . 74.2 110.878 179.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.77 -48.24 59.98 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.196 -0.456 . . . . 74.23 110.841 -179.977 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 231' ' ' ILE . . . . . 0.446 HG21 ' HB3' ' A' ' 119' ' ' GLU . 12.8 mt -68.32 -43.82 84.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.237 -0.438 . . . . 73.41 111.203 179.924 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.71 -32.45 73.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.074 -0.512 . . . . 73.32 110.867 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -62.78 -49.8 69.59 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.795 -0.717 . . . . 65.45 112.513 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 18.9 tt -73.13 -32.27 38.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-O 120.803 0.335 . . . . 74.41 111.161 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -67.15 -29.19 68.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.112 -0.495 . . . . 71.13 110.86 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 236' ' ' LYS . . . . . 0.453 ' HE3' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.49 -24.21 58.98 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.2 -0.455 . . . . 74.41 110.903 179.935 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 237' ' ' LEU . . . . . 0.453 ' HB2' ' HE3' ' A' ' 236' ' ' LYS . 1.7 tt -97.58 -29.48 13.42 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.241 -0.436 . . . . 75.41 110.949 179.906 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 238' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -91.91 -35.72 13.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.175 -0.466 . . . . 54.42 110.851 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.255 0 C-N-CA 120.786 -0.721 . . . . 72.22 112.435 -179.971 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 15.8 t-105 . . . . . 0 C--O 1.23 0.077 0 CA-C-O 120.741 0.305 . . . . 71.22 110.926 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -73.17 -36.49 66.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.229 -0.442 . . . . 72.51 110.947 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -63.77 -36.78 85.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.106 -0.497 . . . . 74.32 110.922 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.6 -37.33 86.91 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.139 -0.482 . . . . 74.22 111.124 179.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -67.65 -43.02 81.27 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.238 -0.437 . . . . 73.12 110.861 -179.925 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -73.94 -32.42 63.49 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.201 -0.454 . . . . 72.4 110.891 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 3.5 m-30 -70.65 -36.28 73.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.134 -0.485 . . . . 75.11 110.906 -179.795 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -71.7 -21.02 61.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.118 -0.492 . . . . 75.43 110.9 179.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 5.2 ptmt -74.77 -32.99 62.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.248 -0.433 . . . . 75.45 110.899 179.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.23 -26.4 33.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.244 -0.435 . . . . 74.22 110.852 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -65.3 -7.64 14.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.217 -0.447 . . . . 75.2 110.934 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.097 -0.501 . . . . 74.4 110.94 -179.865 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.9 tt . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.743 0.306 . . . . 74.54 110.87 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -61.38 -48.78 79.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.242 -0.435 . . . . 73.13 110.893 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.79 -51.2 60.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.148 -0.478 . . . . 71.12 111.079 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.474 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.5 OUTLIER -59.78 -49.68 76.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.239 -0.437 . . . . 74.43 110.867 179.976 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.435 ' O ' ' HG2' ' A' ' 43' ' ' GLN . 0.1 OUTLIER -55.34 -37.51 67.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.267 -0.424 . . . . 74.44 110.952 179.884 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.51 -45.58 88.47 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.219 -0.446 . . . . 74.2 110.844 179.798 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.474 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 2.2 pt-20 -60.56 -32.7 71.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.288 -0.414 . . . . 75.11 110.902 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -68.35 -34.32 75.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.032 -0.531 . . . . 63.43 110.865 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.435 ' HG2' ' O ' ' A' ' 39' ' ' LEU . 4.9 mm-40 -58.35 -39.64 80.08 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.275 -0.42 . . . . 75.32 110.895 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.4 mmpt? -66.42 -28.73 68.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.22 -0.445 . . . . 75.11 110.935 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -70.49 -40.92 73.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.19 -0.459 . . . . 73.32 110.932 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -82.03 -35.53 28.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.126 -0.488 . . . . 70.43 110.881 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 101.99 -8.99 56.33 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.711 -0.756 . . . . 64.42 112.518 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.97 139.92 90.52 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.622 0.725 . . . . 74.31 110.922 -179.89 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.74 -52.49 0.32 Allowed 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.651 2.234 . . . . 74.5 112.353 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -52.15 108.06 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.271 -0.422 . . . . 72.24 111.167 179.868 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.425 ' HA ' ' HG3' ' A' ' 43' ' ' GLN . 66.2 p -105.34 156.35 18.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.206 -0.452 . . . . 73.25 111.173 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 58.67 18.21 37.44 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.795 -0.716 . . . . 64.24 112.473 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -113.17 161.1 17.54 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.767 0.318 . . . . 75.23 110.887 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.418 ' HA ' ' HB ' ' A' ' 58' ' ' VAL . 25.8 tp -164.78 93.98 0.66 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.223 -0.444 . . . . 74.32 110.936 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 178.18 -30.91 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.157 -0.474 . . . . 61.31 110.855 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 29.7 t -89.65 -102.24 0.09 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.175 -0.466 . . . . 75.25 110.919 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 65.9 mtt-85 -84.81 -27.13 27.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.184 -0.462 . . . . 74.13 110.953 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.443 ' O ' ' CG1' ' A' ' 61' ' ' ILE . 84.2 t -65.62 -40.77 88.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.09 -0.504 . . . . 72.2 111.125 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -76.85 -31.43 19.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.214 -0.448 . . . . 75.2 111.145 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -65.02 -44.99 87.33 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.164 -0.471 . . . . 73.45 110.836 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.443 ' CG1' ' O ' ' A' ' 58' ' ' VAL . 14.9 pt -59.76 -29.63 43.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.163 -0.472 . . . . 74.52 111.148 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' MET . . . . . 0.435 ' HG2' ' O ' ' A' ' 58' ' ' VAL . 9.7 mmm -60.64 -39.19 87.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.17 -0.468 . . . . 74.01 110.821 179.857 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -93.81 -25.64 17.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.265 -0.425 . . . . 45.15 110.905 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.69 118.35 71.53 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.605 0.717 . . . . 75.32 110.868 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.76 126.29 13.14 Favored 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.683 2.255 . . . . 72.11 112.371 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -121.29 -74.99 0.6 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.169 -0.469 . . . . 73.22 110.862 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 2.8 p -140.72 148.2 40.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.149 -0.478 . . . . 72.31 110.855 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.583 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -93.9 13.88 66.48 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.701 -0.761 . . . . 64.23 112.495 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -101.75 137.49 19.57 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.67 0.748 . . . . 74.23 111.073 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.83 159.12 54.53 Favored 'Trans proline' 0 C--O 1.231 0.153 0 C-N-CA 122.677 2.251 . . . . 63.44 112.33 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -94.53 4.91 53.24 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.198 -0.456 . . . . 74.45 110.813 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.272 -0.422 . . . . 73.52 111.126 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo . . . . . 0 C--O 1.232 0.189 0 CA-C-O 120.804 0.252 . . . . 72.25 112.316 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 5.1 mttp -74.05 164.98 25.94 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.257 -0.428 . . . . 72.53 110.914 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . 0.493 ' CD1' ' HA ' ' A' ' 200' ' ' LEU . 19.6 m95 -52.86 132.5 37.05 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.248 -0.433 . . . . 73.31 110.87 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 5.6 t -115.08 -15.0 11.77 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.19 -0.459 . . . . 71.34 111.084 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -62.48 165.0 6.65 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.302 -0.408 . . . . 73.12 110.893 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.22 -30.26 38.59 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.165 -0.47 . . . . 71.12 110.909 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 1.1 p -148.12 137.84 16.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.214 -0.448 . . . . 74.14 111.174 179.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 97.2 t -119.1 138.66 49.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.158 -0.474 . . . . 72.25 111.141 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 7.5 p -115.87 168.07 10.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.157 -0.474 . . . . 75.51 111.088 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 6.5 p90 -147.08 147.08 30.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.15 -0.477 . . . . 70.51 110.979 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -146.85 136.39 22.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.136 -0.484 . . . . 74.3 110.847 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.426 HD13 ' HB ' ' A' ' 136' ' ' ILE . 16.4 mm -76.05 135.26 27.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.121 -0.49 . . . . 72.4 111.144 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.499 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 21.2 t -88.15 -40.68 13.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.191 -0.459 . . . . 74.41 111.128 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 4.3 t -153.74 158.88 41.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.178 -0.465 . . . . 64.24 110.951 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 10.5 p90 -106.1 147.71 28.64 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.248 -0.433 . . . . 74.1 110.902 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' THR . . . . . 0.539 ' O ' ' O ' ' A' ' 100' ' ' LEU . 0.3 OUTLIER -81.71 140.76 34.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.137 -0.483 . . . . 75.33 111.183 179.961 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -62.18 -15.98 49.95 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.244 -0.434 . . . . 72.14 110.834 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -91.16 -25.33 19.62 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.225 -0.443 . . . . 74.13 110.902 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.539 ' O ' ' O ' ' A' ' 97' ' ' THR . 18.4 mt -131.69 140.02 37.02 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.515 0.674 . . . . 72.52 110.928 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . 0.466 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.3 Cg_endo -69.8 150.87 68.53 Favored 'Trans proline' 0 C--O 1.232 0.218 0 C-N-CA 122.653 2.235 . . . . 73.11 112.309 179.872 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 3.1 t-160 -49.27 -29.99 6.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.226 -0.443 . . . . 74.11 110.823 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.466 HG22 ' HB2' ' A' ' 101' ' ' PRO . 16.6 tt -72.7 -43.16 61.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.214 -0.448 . . . . 74.02 111.136 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' THR . . . . . 0.408 ' CG2' HD23 ' A' ' 108' ' ' LEU . 2.3 m -69.63 -38.13 77.06 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.132 -0.485 . . . . 54.24 111.118 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 75.5 t -72.87 -44.61 57.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.226 -0.443 . . . . 73.13 111.096 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.565 ' O ' HG21 ' A' ' 109' ' ' VAL . 29.7 t70 -62.95 -43.22 99.39 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.216 -0.447 . . . . 63.44 110.87 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -70.13 -33.25 71.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.205 -0.452 . . . . 75.02 110.846 -179.839 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.452 ' HB3' ' HD2' ' A' ' 188' ' ' PHE . 0.0 OUTLIER -60.18 -47.59 85.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.164 -0.471 . . . . 75.05 110.9 -179.957 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.565 HG21 ' O ' ' A' ' 106' ' ' ASP . 1.4 m -55.2 -41.46 60.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.161 -0.472 . . . . 72.31 111.171 179.843 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.477 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 42.5 t -70.56 -33.64 71.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.169 -0.469 . . . . 72.14 110.858 -179.857 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -61.59 -33.1 73.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.099 -0.5 . . . . 74.35 110.879 179.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.56 -40.28 9.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.193 -0.458 . . . . 74.32 111.066 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.424 HD13 HD13 ' A' ' 196' ' ' LEU . 0.3 OUTLIER -65.59 -33.62 76.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.181 -0.463 . . . . 74.11 110.913 -179.95 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 44.2 t30 -69.64 -38.23 77.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.181 -0.463 . . . . 75.15 110.899 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.42 -34.23 73.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.138 -0.483 . . . . 74.0 110.865 179.897 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 14.5 m95 -70.23 -50.09 43.42 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.243 -0.435 . . . . 75.23 110.928 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' GLY . . . . . 0.432 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -66.34 -36.42 91.63 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.781 -0.724 . . . . 73.44 112.529 179.872 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 43.2 mtmt -61.66 -16.52 49.45 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.706 0.289 . . . . 74.42 110.838 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . 0.406 ' HG3' HG12 ' A' ' 231' ' ' ILE . 71.3 mm-40 -101.32 13.42 35.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.276 -0.42 . . . . 75.55 110.875 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . 0.432 ' CG1' ' HA2' ' A' ' 117' ' ' GLY . 5.3 pt -148.26 152.18 38.69 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.656 0.741 . . . . 71.34 111.134 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.66 4.7 1.99 Allowed 'Trans proline' 0 C--O 1.232 0.212 0 C-N-CA 122.718 2.279 . . . . 75.35 112.387 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.414 ' HB3' ' H ' ' A' ' 123' ' ' HIS . 10.2 mt -60.72 -158.34 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.243 -0.435 . . . . 73.22 110.936 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . 0.414 ' H ' ' HB3' ' A' ' 122' ' ' LEU . 4.3 t60 -161.7 140.69 9.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.144 -0.48 . . . . 74.12 110.809 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 37.9 m-85 -125.0 148.41 48.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.192 -0.458 . . . . 75.54 110.875 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.38 141.09 52.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.154 -0.476 . . . . 75.14 110.854 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.98 139.87 35.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.217 -0.447 . . . . 74.04 110.927 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 17.3 m -102.81 131.97 49.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.151 -0.477 . . . . 50.13 111.15 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -144.41 -23.14 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.219 -0.446 . . . . 74.43 111.132 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -138.77 109.1 6.47 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.188 -0.46 . . . . 73.32 110.896 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 108.18 -159.84 14.12 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.714 -0.755 . . . . 62.11 112.501 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -101.89 155.66 18.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.792 0.33 . . . . 71.11 111.15 -179.877 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -112.22 165.24 12.34 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.181 -0.463 . . . . 72.32 111.088 179.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -67.44 -62.8 1.24 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.181 -0.463 . . . . 75.41 110.895 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 45.5 mt -87.67 139.8 16.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.227 -0.442 . . . . 71.04 111.163 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' MET . . . . . 0.499 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 16.4 mmm -114.33 130.19 56.66 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.2 -0.455 . . . . 72.43 110.904 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.426 ' HB ' HD13 ' A' ' 93' ' ' ILE . 0.3 OUTLIER -111.17 88.15 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.3 -0.409 . . . . 70.04 111.119 179.969 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -134.11 157.27 22.78 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.673 -0.775 . . . . 63.34 112.389 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 31.2 p90 -105.43 151.62 24.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.886 0.374 . . . . 74.01 110.871 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.446 ' CA ' ' HB2' ' A' ' 174' ' ' GLU . . . 169.64 168.81 0.05 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.197 -0.456 . . . . 71.21 111.089 179.901 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 18.1 mtp180 -102.64 172.87 6.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.18 -0.463 . . . . 72.34 110.849 -179.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -54.03 -17.43 7.43 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.707 -0.759 . . . . 74.24 112.54 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -85.58 13.09 7.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.865 0.364 . . . . 75.03 111.188 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 143' ' ' HIS . . . . . 0.412 ' HB3' ' HB2' ' A' ' 139' ' ' ALA . 5.1 p80 -85.91 1.91 48.12 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.21 -0.45 . . . . 73.45 110.864 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 106.07 38.47 2.31 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.764 -0.732 . . . . 60.43 112.465 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -139.71 176.47 8.71 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.844 0.354 . . . . 72.14 110.882 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 66.9 m -85.7 166.76 15.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.222 -0.445 . . . . 64.54 110.844 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 66.23 127.73 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.69 0.757 . . . . 73.4 110.89 -179.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.74 152.41 69.41 Favored 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.709 2.273 . . . . 74.53 112.408 179.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 149' ' ' PHE . . . . . 0.48 ' C ' ' H ' ' A' ' 151' ' ' GLY . 1.5 p90 -52.65 -25.58 11.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.26 -0.427 . . . . 70.0 110.887 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 75.97 -20.87 0.33 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.179 -0.464 . . . . 72.24 110.875 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . 0.48 ' H ' ' C ' ' A' ' 149' ' ' PHE . . . 81.44 -161.29 42.69 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.73 -0.748 . . . . 75.42 112.417 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.68 141.88 46.76 Favored 'Trans proline' 0 C--N 1.343 0.243 0 C-N-CA 122.683 2.255 . . . . 75.11 112.403 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 103.71 -133.29 11.4 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.746 -0.74 . . . . 70.32 112.497 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -37.34 148.31 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.943 0.401 . . . . 74.45 110.855 -179.847 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 59.6 m 65.72 115.11 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.142 -0.481 . . . . 63.14 111.108 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 156' ' ' LEU . . . . . 0.544 HD12 HG13 ' A' ' 186' ' ' ILE . 1.0 OUTLIER -103.9 -52.72 2.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.179 -0.464 . . . . 75.02 110.897 179.975 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . 0.583 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -153.76 148.27 26.16 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.235 -0.438 . . . . 73.44 111.073 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 26.3 p-80 -111.01 117.49 33.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.21 -0.45 . . . . 74.34 110.831 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -109.81 148.3 31.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.221 -0.445 . . . . 74.42 111.071 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 -104.06 169.5 8.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.172 -0.467 . . . . 75.31 110.836 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -104.42 161.47 22.77 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.575 0.703 . . . . 71.14 111.161 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.68 88.11 0.53 Allowed 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.724 2.283 . . . . 74.44 112.348 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -146.43 136.78 6.44 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.767 -0.73 . . . . 72.32 112.463 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 2.7 m 72.24 -69.2 0.19 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.82 0.343 . . . . 73.1 111.122 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . 160.44 -59.49 0.31 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.76 -0.733 . . . . 74.03 112.527 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 10.3 tt -54.07 -35.13 61.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.865 0.364 . . . . 75.02 110.944 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -74.28 -163.75 10.07 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.726 -0.75 . . . . 43.43 112.494 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 73.13 11.9 79.32 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.676 -0.773 . . . . 74.31 112.435 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 61.7 m-20 -91.51 171.38 9.23 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.829 0.347 . . . . 63.41 110.855 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -117.5 131.58 56.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.211 -0.45 . . . . 74.21 111.082 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 28.7 m170 -124.72 158.86 32.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.21 -0.45 . . . . 72.53 110.854 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 172' ' ' PHE . . . . . 0.432 ' HB3' ' CZ2' ' A' ' 178' ' ' TRP . 25.0 m-85 -134.03 143.99 48.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.183 -0.462 . . . . 71.44 110.896 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 173' ' ' ASP . . . . . 0.438 ' CB ' ' O ' ' A' ' 156' ' ' LEU . 49.1 t0 -71.07 103.28 2.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.109 -0.496 . . . . 74.11 110.829 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 174' ' ' GLU . . . . . 0.446 ' HB2' ' CA ' ' A' ' 139' ' ' ALA . 0.5 OUTLIER -58.27 -16.92 15.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.158 -0.474 . . . . 74.45 110.907 -179.939 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -77.85 -15.16 59.26 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.148 -0.478 . . . . 73.32 110.851 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -89.73 176.78 6.72 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.202 -0.454 . . . . 71.41 110.878 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 77.8 mtt180 -103.02 123.05 45.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.143 -0.481 . . . . 74.32 110.882 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 178' ' ' TRP . . . . . 0.433 ' CZ3' ' HB ' ' A' ' 186' ' ' ILE . 44.4 m95 -117.48 132.38 56.56 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.217 -0.447 . . . . 74.32 110.904 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 3.5 t -177.46 164.13 2.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.235 -0.439 . . . . 74.13 111.15 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -124.03 -68.77 0.85 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.211 -0.45 . . . . 61.52 110.818 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -66.15 -10.87 53.8 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.772 -0.728 . . . . 62.41 112.548 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 182' ' ' SER . . . . . 0.435 ' O ' ' C ' ' A' ' 183' ' ' SER . 0.2 OUTLIER -97.65 -24.34 15.56 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.887 0.375 . . . . 74.0 110.854 -179.766 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 183' ' ' SER . . . . . 0.435 ' C ' ' O ' ' A' ' 182' ' ' SER . 1.8 p 34.55 65.43 0.34 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.133 -0.485 . . . . 64.12 110.815 -179.838 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -117.1 -33.76 4.6 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.157 -0.474 . . . . 74.43 110.895 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -124.54 -136.33 4.6 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.797 -0.716 . . . . 74.22 112.508 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 186' ' ' ILE . . . . . 0.544 HG13 HD12 ' A' ' 156' ' ' LEU . 7.3 mm -79.21 105.88 9.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-O 120.872 0.368 . . . . 73.22 111.092 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -51.07 123.9 10.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.138 -0.483 . . . . 71.31 110.838 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 188' ' ' PHE . . . . . 0.452 ' HD2' ' HB3' ' A' ' 108' ' ' LEU . 4.3 t80 -53.6 -35.52 60.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.171 -0.468 . . . . 75.45 110.896 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . 0.448 HD23 HD12 ' A' ' 108' ' ' LEU . 0.1 OUTLIER -67.46 -47.38 70.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.113 -0.494 . . . . 60.14 110.915 -179.892 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -66.06 -37.55 86.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.159 -0.473 . . . . 74.22 110.948 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -72.54 -35.34 68.02 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.109 -0.496 . . . . 61.32 111.095 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 192' ' ' ALA . . . . . 0.487 ' O ' ' HB2' ' A' ' 196' ' ' LEU . . . -60.8 -44.62 96.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.235 -0.439 . . . . 52.32 111.04 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -58.1 -44.47 87.69 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.219 -0.446 . . . . 72.43 111.162 -179.884 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 2.8 t60 -72.58 -42.76 64.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.138 -0.483 . . . . 71.44 110.842 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -68.84 -47.23 66.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.233 -0.44 . . . . 71.01 111.114 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 196' ' ' LEU . . . . . 0.487 ' HB2' ' O ' ' A' ' 192' ' ' ALA . 4.5 mm? -63.13 -43.61 97.91 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.239 -0.437 . . . . 74.52 110.912 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -56.2 -29.29 56.02 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.707 -0.758 . . . . 62.43 112.522 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 198' ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -68.03 -40.32 82.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.864 0.364 . . . . 75.21 110.899 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.85 -21.17 62.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.17 -0.468 . . . . 73.13 110.828 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 200' ' ' LEU . . . . . 0.493 ' HA ' ' CD1' ' A' ' 84' ' ' TRP . 0.6 OUTLIER -90.44 2.75 55.35 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.147 -0.479 . . . . 75.12 110.915 179.992 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 83.71 -4.03 83.5 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.729 -0.748 . . . . 50.41 112.483 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 202' ' ' MET . . . . . . . . . . . . . 97.9 mmm -63.85 133.46 53.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.789 0.328 . . . . 71.04 110.877 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -101.48 -176.34 28.6 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.781 -0.724 . . . . 64.44 112.526 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 20.7 m-70 -73.84 144.34 45.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.798 0.332 . . . . 74.32 110.893 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -103.93 153.46 20.77 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.249 -0.432 . . . . 72.42 110.838 -179.776 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 6.5 p -87.79 -4.78 58.86 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.486 . . . . 72.22 110.814 -179.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.55 137.82 83.4 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.619 0.723 . . . . 65.11 110.881 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 -6.62 19.01 Favored 'Trans proline' 0 C--N 1.342 0.222 0 C-N-CA 122.682 2.254 . . . . 74.53 112.336 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -127.92 30.16 5.31 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.189 -0.46 . . . . 63.52 110.886 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 210' ' ' ALA . . . . . 0.465 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.22 145.51 26.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.194 -0.457 . . . . 64.4 111.132 179.851 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -68.35 -27.52 37.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.238 -0.437 . . . . 75.23 111.145 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -98.25 10.53 40.41 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.209 -0.451 . . . . 75.22 110.846 179.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 213' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -55.71 118.08 18.19 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.698 0.761 . . . . 73.43 110.909 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.82 -18.47 36.71 Favored 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 122.611 2.207 . . . . 63.01 112.363 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -84.79 49.97 1.82 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.174 -0.466 . . . . 74.24 111.172 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 5.5 t80 . . . . . 0 C--N 1.328 -0.346 0 CA-C-N 116.202 -0.454 . . . . 74.42 110.925 -179.915 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.458 -0.029 0 CA-C-O 120.906 0.384 . . . . 71.11 110.938 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -143.87 -167.9 2.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.087 -0.506 . . . . 65.02 110.919 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 226' ' ' LEU . . . . . 0.405 ' HG ' ' HG3' ' A' ' 119' ' ' GLU . 0.6 OUTLIER -59.56 149.2 30.73 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.262 -0.426 . . . . 62.53 110.939 179.885 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 227' ' ' SER . . . . . 0.465 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 1.4 t -86.93 154.84 20.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 74.21 110.932 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -62.82 -65.35 0.7 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.214 -0.448 . . . . 74.54 110.897 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -55.59 -26.09 41.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.225 -0.443 . . . . 74.2 110.863 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -69.64 -48.25 60.58 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.198 -0.456 . . . . 74.23 110.872 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 231' ' ' ILE . . . . . 0.406 HG12 ' HG3' ' A' ' 119' ' ' GLU . 8.6 mt -68.29 -42.82 84.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.171 -0.468 . . . . 73.41 111.211 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.21 -32.58 74.02 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.104 -0.498 . . . . 73.32 110.888 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -65.8 -48.3 68.01 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.748 -0.739 . . . . 65.45 112.495 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 11.8 tt -72.82 -30.61 33.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.79 0.328 . . . . 74.41 111.113 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -70.24 -24.03 63.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.147 -0.479 . . . . 71.13 110.907 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 236' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.49 -27.29 60.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.199 -0.455 . . . . 74.41 110.908 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 237' ' ' LEU . . . . . . . . . . . . . 9.8 tt -98.03 -32.55 11.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.167 -0.47 . . . . 75.41 110.911 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 238' ' ' TYR . . . . . . . . . . . . . 32.4 m-85 -91.87 -35.18 14.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.2 -0.455 . . . . 54.42 110.917 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.33 0 C-N-CA 120.746 -0.74 . . . . 72.22 112.494 179.979 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 5.4 t-105 . . . . . 0 C--O 1.23 0.066 0 CA-C-O 120.699 0.285 . . . . 71.22 110.933 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -73.31 -39.16 65.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.259 -0.428 . . . . 72.51 110.921 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 -74.05 -35.97 64.35 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.135 -0.484 . . . . 74.32 110.93 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -56.91 -44.16 82.13 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.225 -0.443 . . . . 74.22 111.123 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -73.53 -37.41 65.62 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.189 -0.46 . . . . 73.12 110.889 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -67.92 -30.98 70.44 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.174 -0.466 . . . . 72.4 110.93 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -69.95 -35.99 74.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.207 -0.451 . . . . 75.11 110.944 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.78 -20.93 64.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.17 -0.468 . . . . 75.43 110.923 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 5.7 ptmt -74.85 -31.48 61.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.168 -0.469 . . . . 75.45 110.903 179.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.2 ptp180 -86.37 -27.93 23.94 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.202 -0.454 . . . . 74.22 110.896 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.0 m-30 -77.82 -0.84 28.78 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.256 -0.429 . . . . 75.2 110.856 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 . . . . . 0 C--N 1.329 -0.326 0 CA-C-N 116.112 -0.495 . . . . 74.4 110.946 -179.808 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.613 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 3.6 mm? . . . . . 0 CA--C 1.526 0.041 0 CA-C-O 120.743 0.306 . . . . 74.54 110.901 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.75 -50.37 72.46 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.165 -0.47 . . . . 73.13 110.88 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -52.64 -36.56 56.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.161 -0.472 . . . . 71.12 111.111 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.463 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.1 OUTLIER -70.7 -41.61 71.73 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.182 -0.463 . . . . 74.43 110.92 179.931 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.613 ' HG ' ' O ' ' A' ' 35' ' ' LEU . 25.4 mt -54.32 -38.05 65.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.215 -0.448 . . . . 74.44 110.951 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.0 mttt -58.72 -45.57 89.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.16 -0.473 . . . . 74.2 110.929 179.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.463 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 2.3 pt-20 -60.93 -32.68 72.17 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.219 -0.446 . . . . 75.11 110.912 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 4.5 ttt -66.83 -34.16 77.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.15 -0.477 . . . . 63.43 110.926 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.485 ' HG3' ' HA ' ' A' ' 51' ' ' THR . 2.5 mm-40 -58.67 -40.05 82.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.455 . . . . 75.32 110.89 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.7 mmpt? -72.79 -33.49 66.3 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.233 -0.44 . . . . 75.11 110.875 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 32.7 t80 -71.0 -37.18 72.67 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.26 -0.427 . . . . 73.32 110.848 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -81.78 -35.22 29.8 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.22 -0.446 . . . . 70.43 110.931 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 105.83 -10.34 44.76 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.748 -0.739 . . . . 64.42 112.509 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -66.0 135.79 95.35 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.619 0.723 . . . . 74.31 110.898 -179.906 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.76 -52.9 0.3 Allowed 'Trans proline' 0 C--N 1.342 0.228 0 C-N-CA 122.697 2.264 . . . . 74.5 112.325 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -52.67 108.22 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.205 -0.452 . . . . 72.24 111.13 179.949 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.485 ' HA ' ' HG3' ' A' ' 43' ' ' GLN . 21.1 p -107.88 168.09 9.52 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.165 -0.47 . . . . 73.25 111.126 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 60.16 16.92 43.49 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.688 -0.768 . . . . 64.24 112.494 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -128.12 134.02 49.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.772 0.32 . . . . 75.23 110.844 -179.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.409 ' HA ' ' HB ' ' A' ' 58' ' ' VAL . 24.6 tp -145.36 93.1 2.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.193 -0.458 . . . . 74.32 110.892 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.6 p30 174.38 -29.68 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.219 -0.446 . . . . 61.31 110.925 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 24.1 t -83.86 -97.68 0.06 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.151 -0.477 . . . . 75.25 110.833 -179.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 8.8 tpt180 -85.09 -33.05 22.5 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.14 -0.482 . . . . 74.13 110.949 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.409 ' HB ' ' HA ' ' A' ' 54' ' ' LEU . 44.7 t -59.06 -49.34 83.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.191 -0.459 . . . . 72.2 111.148 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -63.99 -30.9 51.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.162 -0.472 . . . . 75.2 111.082 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.01 -40.4 84.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.261 -0.427 . . . . 73.45 110.931 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -78.26 -30.1 15.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.133 -0.485 . . . . 74.52 111.144 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 7.9 mmm -68.18 -35.14 77.55 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.181 -0.463 . . . . 74.01 110.893 179.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -83.87 -24.33 30.91 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.182 -0.463 . . . . 45.15 110.918 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.25 148.48 50.11 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.54 0.686 . . . . 75.32 110.958 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.8 154.22 67.85 Favored 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.663 2.242 . . . . 72.11 112.344 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 40.9 ttp180 -153.38 -84.02 0.07 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.225 -0.443 . . . . 73.22 110.872 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -145.48 156.19 43.57 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.178 -0.465 . . . . 72.31 110.925 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.527 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -100.12 20.55 48.39 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.701 -0.762 . . . . 64.23 112.488 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.408 ' CG1' ' HD2' ' A' ' 70' ' ' PRO . 0.0 OUTLIER -111.29 141.88 25.28 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.725 0.774 . . . . 74.23 111.122 179.979 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . 0.408 ' HD2' ' CG1' ' A' ' 69' ' ' VAL . 54.4 Cg_endo -69.71 139.02 39.36 Favored 'Trans proline' 0 C--N 1.342 0.207 0 C-N-CA 122.736 2.291 . . . . 63.44 112.349 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 87.7 m-20 -61.55 -17.01 53.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.191 -0.459 . . . . 74.45 110.89 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.186 -0.461 . . . . 73.52 111.165 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.821 0.259 . . . . 72.25 112.29 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.9 mttp -82.33 163.35 21.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.24 -0.436 . . . . 72.53 110.905 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . 0.493 ' CD1' ' HA ' ' A' ' 200' ' ' LEU . 47.0 m95 -62.95 135.2 57.17 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.226 -0.443 . . . . 73.31 110.955 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.35 1.37 13.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.303 -0.408 . . . . 71.34 111.154 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -77.81 163.71 25.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.152 -0.476 . . . . 73.12 110.908 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.72 -6.81 59.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.156 -0.475 . . . . 71.12 110.929 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -170.51 138.83 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.206 -0.452 . . . . 74.14 111.141 179.9 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 95.9 t -123.39 135.62 62.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.234 -0.439 . . . . 72.25 111.088 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 9.5 p -115.07 168.1 10.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.155 -0.475 . . . . 75.51 111.142 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.404 ' N ' ' CD1' ' A' ' 91' ' ' TYR . 2.9 p90 -144.58 147.42 33.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.18 -0.464 . . . . 70.51 110.947 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.4 ' HB2' ' HB2' ' A' ' 132' ' ' ALA . 5.4 tpt85 -148.03 134.72 19.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.138 -0.483 . . . . 74.3 110.871 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.2 mm -77.21 135.32 26.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.183 -0.462 . . . . 72.4 111.128 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.47 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 18.3 t -93.98 -40.5 11.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.22 -0.445 . . . . 74.41 111.138 179.857 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -151.63 169.56 21.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.081 -0.509 . . . . 64.24 110.848 -179.865 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 16.1 p90 -130.12 155.24 46.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.141 -0.481 . . . . 74.1 110.971 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.5 t -100.64 142.19 32.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 75.33 111.136 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -52.08 -18.46 1.44 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.215 -0.448 . . . . 72.14 110.859 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.97 -36.7 85.23 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.186 -0.461 . . . . 74.13 110.863 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.7 mp -144.07 152.81 55.72 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-O 121.623 0.725 . . . . 72.52 110.934 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . 0.406 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.7 Cg_endo -69.83 151.27 68.6 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.662 2.241 . . . . 73.11 112.319 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 2.7 t-160 -50.8 -28.3 9.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.18 -0.464 . . . . 74.11 110.88 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.406 HG22 ' HB2' ' A' ' 101' ' ' PRO . 2.7 tp -75.65 -38.32 37.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.205 -0.452 . . . . 74.02 111.068 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 3.1 m -69.21 -37.88 78.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.168 -0.469 . . . . 54.24 111.125 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 65.5 t -71.68 -44.48 69.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.214 -0.448 . . . . 73.13 111.15 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.613 ' O ' HG22 ' A' ' 109' ' ' VAL . 26.9 t0 -63.96 -38.55 91.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 63.44 110.85 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . 0.511 ' HG3' ' N ' ' A' ' 108' ' ' LEU . 0.0 OUTLIER -70.55 -33.44 71.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.189 -0.46 . . . . 75.02 110.875 -179.89 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.523 ' HB3' ' HD1' ' A' ' 188' ' ' PHE . 0.0 OUTLIER -66.21 -48.55 70.25 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.201 -0.454 . . . . 75.05 110.922 -179.993 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.613 HG22 ' O ' ' A' ' 106' ' ' ASP . 1.5 m -55.01 -43.17 68.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.189 -0.459 . . . . 72.31 111.06 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.487 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 45.3 t -70.65 -33.93 71.49 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.194 -0.457 . . . . 72.14 110.869 -179.789 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.1 -33.17 73.94 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.087 -0.506 . . . . 74.35 110.928 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.71 -40.27 9.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.244 -0.434 . . . . 74.32 111.135 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.413 HD13 HD12 ' A' ' 196' ' ' LEU . 0.4 OUTLIER -64.32 -33.04 74.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.135 -0.484 . . . . 74.11 110.915 179.981 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 45.0 t30 -69.82 -40.14 76.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.174 -0.466 . . . . 75.15 110.876 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -59.71 -34.33 72.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.163 -0.471 . . . . 74.0 110.921 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 13.3 m95 -65.8 -52.24 52.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.223 -0.444 . . . . 75.23 110.922 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' GLY . . . . . 0.445 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -63.52 -34.01 88.8 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.694 -0.765 . . . . 73.44 112.497 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.4 mtmt -63.67 -14.44 52.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.752 0.31 . . . . 74.42 110.892 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 61.2 mm-40 -104.04 13.27 32.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.233 -0.44 . . . . 75.55 110.894 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . 0.445 ' CG1' ' HA2' ' A' ' 117' ' ' GLY . 6.7 pt -147.71 153.13 42.58 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.653 0.74 . . . . 71.34 111.149 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 1.99 3.91 Favored 'Trans proline' 0 C--N 1.342 0.226 0 C-N-CA 122.658 2.239 . . . . 75.35 112.362 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.42 ' HB3' ' H ' ' A' ' 123' ' ' HIS . 5.9 mt -61.46 -158.25 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.208 -0.451 . . . . 73.22 110.885 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . 0.42 ' H ' ' HB3' ' A' ' 122' ' ' LEU . 5.0 t60 -160.15 145.05 14.82 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.116 -0.493 . . . . 74.12 110.843 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 42.4 m-85 -126.08 148.94 49.23 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.174 -0.466 . . . . 75.54 110.882 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.01 140.96 51.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.16 -0.473 . . . . 75.14 110.857 -179.921 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.01 141.19 34.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 74.04 110.869 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 22.2 m -102.92 133.79 45.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.214 -0.448 . . . . 50.13 111.177 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -147.06 -24.83 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.191 -0.459 . . . . 74.43 111.19 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -136.72 109.15 7.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.117 -0.492 . . . . 73.32 110.885 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.44 -159.74 14.39 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.756 -0.735 . . . . 62.11 112.482 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -101.8 155.54 18.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.786 0.326 . . . . 71.11 111.168 -179.88 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . 0.4 ' HB2' ' HB2' ' A' ' 92' ' ' ARG . . . -112.07 165.38 12.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.2 -0.455 . . . . 72.32 111.083 179.86 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -66.48 -62.8 1.27 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.191 -0.459 . . . . 75.41 110.853 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 37.6 mt -86.41 130.48 36.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.211 -0.45 . . . . 71.04 111.143 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' MET . . . . . 0.47 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 13.7 mmm -107.06 124.9 50.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.12 -0.491 . . . . 72.43 110.914 179.877 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -108.52 92.29 2.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.23 -0.441 . . . . 70.04 111.096 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . 0.401 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -130.31 170.15 20.99 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.738 -0.744 . . . . 63.34 112.497 179.865 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -108.61 149.62 28.65 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.875 0.369 . . . . 74.01 110.938 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . 175.83 166.91 0.39 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.456 . . . . 71.21 111.1 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 22.2 mtm180 -104.26 173.09 6.45 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.214 -0.448 . . . . 72.34 110.908 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -58.09 -15.73 23.04 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.722 -0.751 . . . . 74.24 112.466 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -99.05 13.36 33.09 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.769 0.319 . . . . 75.03 111.165 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 5.0 p80 -72.26 -8.86 57.13 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.172 -0.467 . . . . 73.45 110.843 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 117.95 50.38 0.35 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.773 -0.727 . . . . 60.43 112.55 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -172.7 171.86 4.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.808 0.337 . . . . 72.14 110.911 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 27.1 p -64.09 -179.79 0.46 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.18 -0.464 . . . . 64.54 110.849 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 147' ' ' TYR . . . . . 0.416 ' HA ' ' HD2' ' A' ' 148' ' ' PRO . 0.3 OUTLIER 64.48 103.92 0.03 OUTLIER Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.727 0.775 . . . . 73.4 110.949 -179.905 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 148' ' ' PRO . . . . . 0.416 ' HD2' ' HA ' ' A' ' 147' ' ' TYR . 54.2 Cg_endo -69.77 151.97 69.17 Favored 'Trans proline' 0 C--N 1.342 0.228 0 C-N-CA 122.612 2.208 . . . . 74.53 112.372 179.935 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 149' ' ' PHE . . . . . 0.404 ' O ' ' CG ' ' A' ' 150' ' ' ASP . 0.3 OUTLIER -53.38 -24.26 11.83 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.166 -0.47 . . . . 70.0 110.842 -179.942 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . 0.404 ' CG ' ' O ' ' A' ' 149' ' ' PHE . 1.9 p30 44.93 25.43 0.15 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.191 -0.459 . . . . 72.24 110.861 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 44.69 -165.05 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.719 -0.753 . . . . 75.42 112.48 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.72 144.36 53.98 Favored 'Trans proline' 0 C--N 1.343 0.24 0 C-N-CA 122.632 2.222 . . . . 75.11 112.36 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . 0.457 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 105.57 -131.76 10.8 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.775 -0.726 . . . . 70.32 112.445 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 154' ' ' ASN . . . . . 0.457 ' C ' ' O ' ' A' ' 153' ' ' GLY . 3.5 p30 -33.37 135.82 0.11 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.851 0.358 . . . . 74.45 110.891 -179.875 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 74.24 101.88 0.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.234 -0.439 . . . . 63.14 111.189 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 156' ' ' LEU . . . . . 0.487 HD11 HG13 ' A' ' 186' ' ' ILE . 0.4 OUTLIER -82.41 -56.89 3.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.16 -0.473 . . . . 75.02 110.94 179.98 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . 0.527 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -162.87 149.09 12.39 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.245 -0.434 . . . . 73.44 111.131 179.769 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 18.9 p-80 -105.19 126.09 51.71 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.267 -0.424 . . . . 74.34 110.809 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -110.53 153.06 25.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.181 -0.463 . . . . 74.42 111.105 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 15.1 m-85 -108.55 152.25 25.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.23 -0.441 . . . . 75.31 110.877 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -96.66 164.16 18.75 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.617 0.722 . . . . 71.14 111.112 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 85.33 0.62 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.672 2.248 . . . . 74.44 112.361 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -134.57 127.63 4.55 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.718 -0.753 . . . . 72.32 112.462 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 2.7 m 72.72 -69.78 0.18 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.847 0.356 . . . . 73.1 111.102 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . 166.61 -59.44 0.23 Allowed Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.767 -0.73 . . . . 74.03 112.454 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 8.7 tt -53.99 -37.7 64.29 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.741 0.305 . . . . 75.02 110.891 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -73.98 -166.19 13.21 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.68 -0.772 . . . . 43.43 112.519 179.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 73.01 18.04 78.93 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.642 -0.789 . . . . 74.31 112.483 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 74.9 m-20 -91.97 -172.4 3.15 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.796 0.331 . . . . 63.41 110.824 -179.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -124.47 131.36 53.49 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.19 -0.459 . . . . 74.21 111.116 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 10.9 m170 -129.0 137.91 51.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.216 -0.447 . . . . 72.53 110.809 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 47.1 m-85 -121.55 140.33 52.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.208 -0.451 . . . . 71.44 110.899 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 55.6 t0 -73.47 100.84 3.35 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.203 -0.453 . . . . 74.11 110.902 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.83 -16.42 11.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.115 -0.493 . . . . 74.45 110.86 -179.886 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -79.03 -16.37 56.94 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.125 -0.489 . . . . 73.32 110.875 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 31.4 mm-40 -83.48 -175.79 5.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.194 -0.457 . . . . 71.41 110.824 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -112.18 116.53 30.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.136 -0.484 . . . . 74.32 110.857 -179.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 49.6 m95 -116.82 139.41 50.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.176 -0.466 . . . . 74.32 110.947 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 9.0 t -177.46 163.6 1.99 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.221 -0.445 . . . . 74.13 111.231 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -125.12 -68.86 0.82 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.241 -0.436 . . . . 61.52 110.852 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -64.81 -12.15 52.59 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.706 -0.759 . . . . 62.41 112.523 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 182' ' ' SER . . . . . 0.425 ' O ' ' C ' ' A' ' 183' ' ' SER . 0.4 OUTLIER -94.52 -24.44 17.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.925 0.393 . . . . 74.0 110.876 -179.743 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 183' ' ' SER . . . . . 0.425 ' C ' ' O ' ' A' ' 182' ' ' SER . 3.2 p 35.32 58.03 0.82 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.103 -0.499 . . . . 64.12 110.894 -179.821 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -116.85 -33.53 4.75 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.101 -0.5 . . . . 74.43 110.915 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -119.79 -139.37 5.9 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.696 -0.764 . . . . 74.22 112.414 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 186' ' ' ILE . . . . . 0.487 HG13 HD11 ' A' ' 156' ' ' LEU . 6.9 mm -79.47 100.08 3.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.864 0.364 . . . . 73.22 111.118 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 28.6 m-20 -49.19 121.7 5.18 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.195 -0.457 . . . . 71.31 110.944 179.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 188' ' ' PHE . . . . . 0.523 ' HD1' ' HB3' ' A' ' 108' ' ' LEU . 1.5 t80 -54.03 -36.25 62.83 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.196 -0.456 . . . . 75.45 110.884 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . 0.414 HD22 HD13 ' A' ' 108' ' ' LEU . 0.2 OUTLIER -67.57 -47.62 69.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.139 -0.482 . . . . 60.14 110.867 -179.934 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 44.3 t80 -69.48 -38.94 77.92 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.256 -0.429 . . . . 74.22 110.901 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -72.13 -35.23 69.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.154 -0.475 . . . . 61.32 111.133 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 192' ' ' ALA . . . . . 0.481 ' O ' ' HB2' ' A' ' 196' ' ' LEU . . . -57.12 -45.02 83.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.161 -0.472 . . . . 52.32 111.031 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.97 -42.71 90.58 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.231 -0.44 . . . . 72.43 111.181 -179.886 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 15.0 t-160 -73.21 -38.56 66.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.228 -0.442 . . . . 71.44 110.909 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -75.38 -48.51 22.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 71.01 111.052 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 196' ' ' LEU . . . . . 0.481 ' HB2' ' O ' ' A' ' 192' ' ' ALA . 4.5 mm? -63.81 -40.02 95.63 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.236 -0.438 . . . . 74.52 110.943 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -58.91 -28.59 63.65 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.742 -0.742 . . . . 62.43 112.436 179.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 198' ' ' HIS . . . . . . . . . . . . . 7.1 m-70 -69.29 -32.42 71.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.738 0.304 . . . . 75.21 110.793 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -70.94 -21.26 62.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.207 -0.451 . . . . 73.13 110.874 -179.748 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 200' ' ' LEU . . . . . 0.493 ' HA ' ' CD1' ' A' ' 84' ' ' TRP . 0.3 OUTLIER -92.54 4.82 52.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.099 -0.501 . . . . 75.12 110.938 -179.984 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 83.37 -9.52 61.23 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.735 -0.745 . . . . 50.41 112.473 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 202' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.83 135.0 48.23 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.88 0.372 . . . . 71.04 110.854 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -109.79 159.22 14.08 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.768 -0.73 . . . . 64.44 112.409 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 12.4 m-70 -52.47 155.78 2.02 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.88 0.371 . . . . 74.32 110.837 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -117.27 153.01 33.67 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.182 -0.463 . . . . 72.42 110.855 -179.784 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 5.2 p -87.73 -4.9 58.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.157 -0.474 . . . . 72.22 110.859 -179.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -71.65 140.53 84.26 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.657 0.741 . . . . 65.11 110.886 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.82 -6.32 18.34 Favored 'Trans proline' 0 C--N 1.342 0.21 0 C-N-CA 122.693 2.262 . . . . 74.53 112.332 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 2.9 p30 -126.85 32.25 5.15 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.23 -0.441 . . . . 63.52 110.874 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 210' ' ' ALA . . . . . 0.478 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.11 146.07 26.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 64.4 111.103 179.845 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -73.63 -27.09 22.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 75.23 111.148 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 3.2 mmm -97.54 14.1 27.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.194 -0.457 . . . . 75.22 110.876 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 213' ' ' TYR . . . . . 0.413 ' CD2' ' OG1' ' A' ' 215' ' ' THR . 0.1 OUTLIER -55.23 121.98 40.23 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-O 121.612 0.72 . . . . 73.43 110.992 -179.95 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.73 -18.79 36.94 Favored 'Trans proline' 0 N--CA 1.465 -0.203 0 C-N-CA 122.716 2.278 . . . . 63.01 112.364 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 215' ' ' THR . . . . . 0.413 ' OG1' ' CD2' ' A' ' 213' ' ' TYR . 5.9 p -84.37 53.28 2.59 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.247 -0.433 . . . . 74.24 111.14 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 8.0 t80 . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.224 -0.444 . . . . 74.42 110.955 -179.978 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 224' ' ' PHE . . . . . 0.434 ' CD1' ' C ' ' A' ' 224' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.909 0.385 . . . . 71.11 110.848 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -143.99 -178.19 5.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.185 -0.461 . . . . 65.02 110.875 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.71 148.02 35.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 62.53 110.909 179.925 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 227' ' ' SER . . . . . 0.478 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 1.4 t -90.71 151.62 21.16 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.198 -0.455 . . . . 74.21 110.826 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 42.6 tt0 -67.46 -60.7 2.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.088 -0.505 . . . . 74.54 110.958 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -58.36 -26.08 62.75 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.214 -0.448 . . . . 74.2 110.865 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -69.78 -48.82 57.82 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.19 -0.459 . . . . 74.23 110.904 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 231' ' ' ILE . . . . . . . . . . . . . 10.5 mt -68.63 -44.83 82.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 73.41 111.153 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.2 -32.77 66.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.176 -0.466 . . . . 73.32 110.902 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -64.26 -49.79 63.99 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.703 -0.76 . . . . 65.45 112.456 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 12.8 tt -73.15 -31.82 36.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.72 0.295 . . . . 74.41 111.115 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -62.65 -24.3 67.54 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.142 -0.481 . . . . 71.13 110.895 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 236' ' ' LYS . . . . . 0.434 ' HE3' ' HB2' ' A' ' 237' ' ' LEU . 0.1 OUTLIER -74.66 -22.11 59.06 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.2 -0.455 . . . . 74.41 110.868 179.994 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 237' ' ' LEU . . . . . 0.434 ' HB2' ' HE3' ' A' ' 236' ' ' LYS . 10.6 tt -97.34 -33.73 11.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.206 -0.452 . . . . 75.41 110.926 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 238' ' ' TYR . . . . . . . . . . . . . 47.4 m-85 -92.04 -35.31 14.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.174 -0.466 . . . . 54.42 110.902 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.355 0 C-N-CA 120.709 -0.757 . . . . 72.22 112.508 179.983 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 16.0 t-105 . . . . . 0 C--O 1.23 0.073 0 CA-C-O 120.73 0.3 . . . . 71.22 110.86 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 78.4 tt0 -62.31 -35.25 78.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.222 -0.445 . . . . 72.51 110.814 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 64.0 mm-40 -74.24 -36.61 63.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.171 -0.468 . . . . 74.32 110.914 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.89 -43.78 78.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.202 -0.453 . . . . 74.22 111.125 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.401 ' HG3' ' N ' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -73.07 -32.18 64.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.182 -0.463 . . . . 73.12 110.933 -179.938 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . 0.401 ' N ' ' HG3' ' A' ' 16' ' ' GLN . 83.4 m-20 -77.66 -30.91 52.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.174 -0.466 . . . . 72.4 110.898 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.97 -35.69 75.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.153 -0.476 . . . . 75.11 110.938 -179.848 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -71.26 -21.41 62.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.118 -0.492 . . . . 75.43 110.92 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 4.1 ptmt -75.32 -28.6 59.72 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.188 -0.46 . . . . 75.45 110.919 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.8 ptp180 -86.36 -27.11 24.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.213 -0.448 . . . . 74.22 110.912 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -59.67 -25.32 64.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.181 -0.463 . . . . 75.2 110.877 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.433 ' O ' ' HB3' ' A' ' 70' ' ' PRO . 14.5 m-85 . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.125 -0.489 . . . . 74.4 110.924 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.756 0.312 . . . . 74.54 110.916 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.4 -51.38 63.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.222 -0.444 . . . . 73.13 110.849 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.28 -51.17 68.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.159 -0.473 . . . . 71.12 111.06 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 5.1 mmtt -59.74 -49.48 77.56 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.209 -0.45 . . . . 74.43 110.917 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -55.19 -38.74 68.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 74.44 110.964 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.38 -46.49 88.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 74.2 111.005 179.751 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -70.39 -37.06 74.45 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.173 -0.467 . . . . 75.11 110.925 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 3.2 ttt -68.73 -46.0 70.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.197 -0.456 . . . . 63.43 110.893 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 18.5 mt-30 -57.31 -43.5 83.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.235 -0.439 . . . . 75.32 110.921 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.6 mmpt? -69.14 -26.73 65.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.213 -0.449 . . . . 75.11 110.86 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -69.99 -36.25 75.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.26 -0.427 . . . . 73.32 110.926 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -80.48 -30.65 37.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.115 -0.493 . . . . 70.43 110.85 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 105.55 -10.55 46.04 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.749 -0.739 . . . . 64.42 112.465 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.411 HD12 HG13 ' A' ' 50' ' ' ILE . 0.6 OUTLIER -63.13 140.06 97.62 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.576 0.703 . . . . 74.31 110.938 -179.881 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.75 -51.9 0.36 Allowed 'Trans proline' 0 C--O 1.231 0.169 0 C-N-CA 122.669 2.246 . . . . 74.5 112.325 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.411 HG13 HD12 ' A' ' 48' ' ' LEU . 0.7 OUTLIER -48.82 108.21 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.238 -0.437 . . . . 72.24 111.146 179.936 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 1.8 t -111.28 159.33 18.04 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.167 -0.47 . . . . 73.25 111.054 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 58.37 17.07 30.71 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.799 -0.715 . . . . 64.24 112.49 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.2 mtp -127.49 161.05 29.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.823 0.344 . . . . 75.23 110.828 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 20.4 tp -154.38 96.81 1.96 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.223 -0.444 . . . . 74.32 110.944 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 177.51 -32.13 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.2 -0.454 . . . . 61.31 110.933 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 5.0 m -79.51 -100.71 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.162 -0.472 . . . . 75.25 110.795 -179.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.0 mmt85 -84.82 -29.4 25.39 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.166 -0.47 . . . . 74.13 110.864 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 16.3 t -58.84 -44.06 89.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.234 -0.439 . . . . 72.2 111.124 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 3.4 mm -75.51 -31.31 23.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.19 -0.459 . . . . 75.2 111.116 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.94 -44.55 92.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.148 -0.478 . . . . 73.45 110.874 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 30.3 pt -64.9 -29.89 48.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.196 -0.456 . . . . 74.52 111.117 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 8.1 mmt -65.16 -36.88 85.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.227 -0.442 . . . . 74.01 110.909 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -90.59 -24.59 20.51 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.177 -0.465 . . . . 45.15 110.948 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 2.8 tppt? -84.88 130.76 51.35 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.552 0.692 . . . . 75.32 110.961 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 126.08 12.89 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.657 2.238 . . . . 72.11 112.36 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 19.7 ttp180 -122.18 -84.67 0.66 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.191 -0.459 . . . . 73.22 110.883 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -145.96 147.46 31.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.18 -0.464 . . . . 72.31 110.891 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.59 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -98.41 20.85 48.8 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.74 -0.743 . . . . 64.23 112.518 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -109.62 130.83 22.35 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.609 0.719 . . . . 74.23 111.165 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . 0.433 ' HB3' ' O ' ' A' ' 23' ' ' TYR . 54.3 Cg_endo -69.79 159.39 53.56 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.647 2.231 . . . . 63.44 112.367 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -113.52 28.62 8.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.237 -0.438 . . . . 74.45 110.872 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 3.2 m . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.165 -0.471 . . . . 73.52 111.163 179.998 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo . . . . . 0 C--O 1.231 0.144 0 CA-C-O 120.878 0.282 . . . . 72.25 112.313 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 2.7 mtpt -96.77 164.72 12.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.167 -0.47 . . . . 72.53 110.932 179.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 40.8 m0 -46.42 110.5 0.28 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.227 -0.442 . . . . 73.31 110.914 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 15.2 t -115.1 1.26 13.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.248 -0.433 . . . . 71.34 111.169 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.4 172.68 3.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.221 -0.445 . . . . 73.12 110.849 -179.837 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.4 -30.43 37.77 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.162 -0.472 . . . . 71.12 110.899 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -159.66 144.83 6.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.449 . . . . 74.14 111.163 179.92 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 12.9 t -127.68 131.92 69.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.252 -0.431 . . . . 72.25 111.15 179.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 22.9 p -115.44 150.51 36.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.222 -0.444 . . . . 75.51 111.165 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 5.7 p90 -130.85 146.41 52.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.191 -0.459 . . . . 70.51 110.931 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 12.6 ttt180 -149.14 137.0 20.54 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.091 -0.504 . . . . 74.3 110.887 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 11.7 mm -75.02 135.25 27.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.153 -0.476 . . . . 72.4 111.157 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.431 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 18.4 t -90.19 -40.51 12.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.189 -0.46 . . . . 74.41 111.105 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 36.2 t -153.94 169.48 23.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.225 -0.443 . . . . 64.24 110.88 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 14.7 p90 -133.07 155.11 49.82 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.111 -0.495 . . . . 74.1 110.954 -179.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.9 t -99.43 141.91 31.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.165 -0.471 . . . . 75.33 111.16 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 7.7 ptp85 -52.01 -19.98 2.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.215 -0.448 . . . . 72.14 110.826 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.9 -34.77 71.88 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.261 -0.427 . . . . 74.13 110.808 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 6.5 mt -136.08 141.14 35.28 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.628 0.728 . . . . 72.52 110.888 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . 0.432 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.8 Cg_endo -69.78 151.0 68.84 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.717 2.278 . . . . 73.11 112.316 179.879 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 2.3 t-160 -53.52 -25.38 16.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.222 -0.445 . . . . 74.11 110.864 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.432 HG22 ' HB2' ' A' ' 101' ' ' PRO . 15.1 tt -77.43 -41.16 29.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.217 -0.447 . . . . 74.02 111.12 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 6.6 m -69.32 -39.05 78.44 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.224 -0.444 . . . . 54.24 111.206 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 71.7 t -71.21 -45.5 70.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.157 -0.474 . . . . 73.13 111.112 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.582 ' O ' HG22 ' A' ' 109' ' ' VAL . 53.6 t0 -63.32 -39.86 95.74 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.196 -0.457 . . . . 63.44 110.854 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . 0.509 ' HG3' ' N ' ' A' ' 108' ' ' LEU . 0.1 OUTLIER -70.15 -33.57 71.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.232 -0.44 . . . . 75.02 110.891 -179.865 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.523 ' HB3' ' HD1' ' A' ' 188' ' ' PHE . 0.0 OUTLIER -65.17 -48.47 73.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.133 -0.485 . . . . 75.05 110.887 -179.957 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.582 HG22 ' O ' ' A' ' 106' ' ' ASP . 1.2 m -55.15 -42.49 65.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.226 -0.443 . . . . 72.31 111.144 179.842 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.484 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 30.9 t -70.15 -34.71 73.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.13 -0.487 . . . . 72.14 110.869 -179.854 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.74 -33.43 75.11 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.124 -0.489 . . . . 74.35 110.895 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -93.51 -42.08 9.43 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.228 -0.442 . . . . 74.32 111.113 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.1 -34.14 77.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.243 -0.435 . . . . 74.11 110.958 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . 0.4 ' CB ' ' O ' ' A' ' 110' ' ' SER . 22.2 t30 -68.6 -35.42 77.32 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.148 -0.478 . . . . 75.15 110.862 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.19 -34.14 77.67 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.236 -0.438 . . . . 74.0 110.882 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 14.6 m95 -67.01 -45.37 77.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.193 -0.458 . . . . 75.23 110.876 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' GLY . . . . . 0.415 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -67.96 -36.5 86.41 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.73 -0.747 . . . . 73.44 112.49 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.26 -17.41 53.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.767 0.317 . . . . 74.42 110.948 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -99.99 13.46 33.89 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.247 -0.433 . . . . 75.55 110.898 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . 0.531 ' C ' ' H ' ' A' ' 122' ' ' LEU . 7.7 pt -149.28 143.69 17.18 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.521 0.677 . . . . 71.34 111.166 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 26.0 0.18 Allowed 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.625 2.216 . . . . 75.35 112.355 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.531 ' H ' ' C ' ' A' ' 120' ' ' ILE . 12.5 mt -78.99 -161.19 0.28 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 73.22 110.903 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . 0.403 ' H ' ' HB3' ' A' ' 122' ' ' LEU . 3.3 t60 -150.63 121.06 7.37 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.148 -0.478 . . . . 74.12 110.865 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 9.2 m-30 -110.61 147.47 34.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.22 -0.445 . . . . 75.54 110.925 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.14 142.07 50.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.455 . . . . 75.14 110.923 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.37 160.09 25.51 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.234 -0.439 . . . . 74.04 110.929 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 17.8 m -103.29 126.57 57.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.258 -0.428 . . . . 50.13 111.062 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -146.9 -11.19 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.138 -0.483 . . . . 74.43 111.066 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -156.78 109.05 2.49 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.203 -0.453 . . . . 73.32 110.95 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 103.04 -164.93 15.89 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.79 -0.719 . . . . 62.11 112.541 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.97 155.44 18.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.798 0.332 . . . . 71.11 111.122 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -112.46 165.55 12.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.242 -0.436 . . . . 72.32 111.093 179.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -76.03 -40.99 52.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.206 -0.452 . . . . 75.41 110.857 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 3.1 mm -93.93 107.65 19.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.168 -0.469 . . . . 71.04 111.164 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' MET . . . . . 0.431 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 8.1 mmm -99.58 121.55 41.36 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.207 -0.451 . . . . 72.43 110.897 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -106.96 97.15 5.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.252 -0.431 . . . . 70.04 111.125 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -129.85 168.1 21.38 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.728 -0.749 . . . . 63.34 112.466 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' PHE . . . . . 0.411 ' O ' ' CB ' ' A' ' 139' ' ' ALA . 44.4 m-85 -105.25 143.46 33.39 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.808 0.337 . . . . 74.01 110.911 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.411 ' CB ' ' O ' ' A' ' 138' ' ' PHE . . . 168.28 166.27 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.132 -0.486 . . . . 71.21 111.044 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 1.5 ptp180 -107.5 174.33 5.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.22 -0.445 . . . . 72.34 110.846 -179.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . 0.487 ' H ' ' HA ' ' A' ' 149' ' ' PHE . . . -54.4 -17.55 8.49 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.785 -0.721 . . . . 74.24 112.463 -179.911 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -89.17 13.26 13.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.899 0.381 . . . . 75.03 111.115 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 6.4 p80 -79.71 0.19 31.53 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.217 -0.447 . . . . 73.45 110.858 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 105.49 51.6 0.85 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.725 -0.75 . . . . 60.43 112.447 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -165.76 175.56 8.67 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.788 0.328 . . . . 72.14 110.898 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.93 177.11 0.82 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 64.54 110.9 -179.823 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 64.69 119.31 0.02 OUTLIER Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.71 0.767 . . . . 73.4 110.936 -179.861 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.72 151.3 69.27 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 122.676 2.251 . . . . 74.53 112.38 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 149' ' ' PHE . . . . . 0.519 ' O ' ' CG ' ' A' ' 150' ' ' ASP . 2.0 p90 -53.72 -32.89 53.73 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.246 -0.434 . . . . 70.0 110.894 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . 0.519 ' CG ' ' O ' ' A' ' 149' ' ' PHE . 2.8 p30 49.99 15.87 0.2 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.123 -0.49 . . . . 72.24 110.815 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . 0.421 ' C ' ' O ' ' A' ' 150' ' ' ASP . . . 36.72 -153.16 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.723 -0.751 . . . . 75.42 112.457 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 143.58 51.42 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.624 2.216 . . . . 75.11 112.354 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . 0.445 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 105.11 -132.53 11.14 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.753 -0.737 . . . . 70.32 112.559 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 154' ' ' ASN . . . . . 0.445 ' C ' ' O ' ' A' ' 153' ' ' GLY . 2.1 p30 -34.67 143.39 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.96 0.409 . . . . 74.45 110.8 -179.889 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 67.69 109.58 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.114 -0.494 . . . . 63.14 111.148 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 156' ' ' LEU . . . . . 0.482 HD12 HG13 ' A' ' 186' ' ' ILE . 0.8 OUTLIER -88.56 -55.41 3.73 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.253 -0.43 . . . . 75.02 110.928 179.962 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . 0.59 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -159.87 148.75 17.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.152 -0.476 . . . . 73.44 111.038 179.81 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 27.3 p-80 -108.25 125.68 51.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.136 -0.484 . . . . 74.34 110.89 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -110.34 166.53 10.91 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.215 -0.448 . . . . 74.42 111.106 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 21.2 m-30 -115.7 147.32 41.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.257 -0.429 . . . . 75.31 110.887 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -79.99 164.28 53.62 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.608 0.718 . . . . 71.14 111.056 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.81 71.44 1.54 Allowed 'Trans proline' 0 N--CA 1.465 -0.154 0 C-N-CA 122.742 2.295 . . . . 74.44 112.306 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -127.44 100.31 0.54 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.763 -0.732 . . . . 72.32 112.518 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 66.9 172.35 0.25 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.85 0.357 . . . . 73.1 111.095 -179.85 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -54.35 -37.13 59.13 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.753 -0.737 . . . . 74.03 112.466 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 4.0 tt -71.26 -19.64 62.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.792 0.33 . . . . 75.02 110.945 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -93.57 144.64 17.21 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.757 -0.735 . . . . 43.43 112.496 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 102.75 13.04 30.85 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.778 -0.725 . . . . 74.31 112.5 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 29.4 m-20 -82.62 167.62 18.11 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.856 0.36 . . . . 63.41 110.86 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -125.75 130.68 51.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.208 -0.451 . . . . 74.21 111.114 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 23.1 m170 -130.66 132.05 45.21 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.286 -0.415 . . . . 72.53 110.887 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -115.8 139.41 50.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 71.44 110.859 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 48.3 t0 -71.31 99.77 2.01 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.121 -0.49 . . . . 74.11 110.854 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 1.6 pp20? -57.21 -16.99 9.42 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.231 -0.441 . . . . 74.45 110.913 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -76.36 -16.21 59.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.17 -0.468 . . . . 73.32 110.887 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 23.6 mm-40 -84.34 -174.62 5.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.2 -0.455 . . . . 71.41 110.903 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 12.2 mtt85 -116.49 116.26 27.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.189 -0.46 . . . . 74.32 110.828 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 13.0 m95 -116.95 146.29 43.08 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.135 -0.484 . . . . 74.32 110.854 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 7.4 t -178.93 163.8 1.41 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.25 -0.432 . . . . 74.13 111.14 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -123.49 -68.11 0.89 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.45 . . . . 61.52 110.901 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -66.63 -10.83 55.68 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.829 -0.701 . . . . 62.41 112.475 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 182' ' ' SER . . . . . 0.455 ' O ' ' C ' ' A' ' 183' ' ' SER . 0.3 OUTLIER -97.32 -24.43 15.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.911 0.386 . . . . 74.0 110.842 -179.716 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 183' ' ' SER . . . . . 0.455 ' C ' ' O ' ' A' ' 182' ' ' SER . 2.9 p 33.33 60.99 0.45 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.107 -0.497 . . . . 64.12 110.926 -179.754 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 16.5 tp -116.85 -33.57 4.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.114 -0.494 . . . . 74.43 110.921 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -121.58 -137.4 5.22 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.747 -0.739 . . . . 74.22 112.514 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 186' ' ' ILE . . . . . 0.482 HG13 HD12 ' A' ' 156' ' ' LEU . 6.6 mm -79.47 99.92 3.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.827 0.346 . . . . 73.22 111.165 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 27.1 m120 -50.93 121.98 6.8 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.2 -0.454 . . . . 71.31 110.85 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 188' ' ' PHE . . . . . 0.523 ' HD1' ' HB3' ' A' ' 108' ' ' LEU . 1.6 t80 -53.93 -35.7 61.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.136 -0.484 . . . . 75.45 110.886 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.21 -47.6 70.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.181 -0.463 . . . . 60.14 110.881 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 6.2 t80 -69.52 -37.26 77.07 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.165 -0.47 . . . . 74.22 110.944 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -72.65 -35.78 67.84 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.098 -0.501 . . . . 61.32 111.071 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 192' ' ' ALA . . . . . 0.447 ' O ' ' HB2' ' A' ' 196' ' ' LEU . . . -61.48 -44.59 96.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.247 -0.433 . . . . 52.32 111.107 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 17.7 m -58.52 -45.22 89.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.172 -0.467 . . . . 72.43 111.136 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 20.8 t-160 -72.59 -40.11 66.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.181 -0.463 . . . . 71.44 110.838 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -71.02 -47.0 61.16 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.232 -0.44 . . . . 71.01 111.165 179.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 196' ' ' LEU . . . . . 0.513 ' N ' HD21 ' A' ' 196' ' ' LEU . 4.5 mm? -64.88 -38.88 92.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.225 -0.443 . . . . 74.52 110.898 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -62.48 -26.69 68.46 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.673 -0.775 . . . . 62.43 112.483 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 198' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -65.24 -41.47 94.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.864 0.364 . . . . 75.21 110.93 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 31.9 t -64.57 -22.4 66.96 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.134 -0.485 . . . . 73.13 110.893 -179.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 2.4 mt -83.11 -2.55 55.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.059 -0.519 . . . . 75.12 110.865 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 84.09 4.7 88.19 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.715 -0.755 . . . . 50.41 112.501 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 202' ' ' MET . . . . . 0.414 ' CE ' ' HB ' ' A' ' 234' ' ' ILE . 43.8 tpp -65.82 144.61 56.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.836 0.35 . . . . 71.04 110.874 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -106.19 159.09 15.24 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.761 -0.733 . . . . 64.44 112.546 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 27.2 m-70 -58.1 166.12 1.68 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.796 0.332 . . . . 74.32 110.913 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 2.1 t -128.56 149.18 50.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.24 -0.436 . . . . 72.42 110.825 -179.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 1.1 m -88.07 -4.28 58.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.081 -0.509 . . . . 72.22 110.843 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 207' ' ' ASP . . . . . 0.429 ' O ' ' CD1' ' A' ' 213' ' ' TYR . 0.1 OUTLIER -71.27 135.51 84.51 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.59 0.709 . . . . 65.11 110.845 -179.962 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.7 -7.7 21.72 Favored 'Trans proline' 0 C--O 1.231 0.148 0 C-N-CA 122.691 2.26 . . . . 74.53 112.352 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 -127.53 24.27 6.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.258 -0.428 . . . . 63.52 110.89 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 210' ' ' ALA . . . . . 0.429 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.55 145.76 26.08 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.112 -0.495 . . . . 64.4 111.113 179.831 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -68.44 -24.94 30.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.144 -0.48 . . . . 75.23 111.146 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 1.5 mpp? -95.09 9.7 38.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.464 . . . . 75.22 110.885 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 213' ' ' TYR . . . . . 0.429 ' CD1' ' O ' ' A' ' 207' ' ' ASP . 1.8 t80 -55.06 116.75 12.15 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.689 0.757 . . . . 73.43 110.961 -179.884 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.81 -17.98 37.02 Favored 'Trans proline' 0 C--O 1.232 0.208 0 C-N-CA 122.639 2.226 . . . . 63.01 112.353 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -83.93 2.85 36.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.251 -0.431 . . . . 74.24 111.132 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 1.2 t80 . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 116.239 -0.437 . . . . 74.42 110.901 -179.967 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.105 0 CA-C-O 120.929 0.395 . . . . 71.11 110.899 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.87 169.32 18.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.096 -0.502 . . . . 65.02 110.914 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.83 150.73 27.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.205 -0.452 . . . . 62.53 110.898 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 227' ' ' SER . . . . . 0.429 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 9.8 t -85.4 159.12 20.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.173 -0.467 . . . . 74.21 110.866 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -64.24 -67.24 0.45 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.163 -0.472 . . . . 74.54 110.926 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -55.12 -25.68 33.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.164 -0.471 . . . . 74.2 110.935 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -69.09 -48.47 62.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.184 -0.462 . . . . 74.23 110.814 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 231' ' ' ILE . . . . . . . . . . . . . 10.2 mt -68.22 -42.94 85.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.216 -0.447 . . . . 73.41 111.137 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 35.4 pttt -65.14 -32.25 73.85 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.164 -0.471 . . . . 73.32 110.872 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -62.8 -48.89 77.51 Favored Glycine 0 C--N 1.33 0.225 0 C-N-CA 120.704 -0.76 . . . . 65.45 112.449 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 234' ' ' ILE . . . . . 0.414 ' HB ' ' CE ' ' A' ' 202' ' ' MET . 11.4 tt -73.05 -31.95 37.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.782 0.325 . . . . 74.41 111.095 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -67.69 -32.71 73.55 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.225 -0.443 . . . . 71.13 110.873 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 236' ' ' LYS . . . . . 0.445 ' HE3' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.17 -22.01 59.6 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.187 -0.46 . . . . 74.41 110.907 179.964 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 237' ' ' LEU . . . . . 0.445 ' HB2' ' HE3' ' A' ' 236' ' ' LYS . 5.7 tt -97.62 -28.2 14.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.264 -0.425 . . . . 75.41 110.957 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 238' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -92.12 -35.67 13.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.145 -0.48 . . . . 54.42 110.964 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.327 0 C-N-CA 120.72 -0.752 . . . . 72.22 112.508 179.952 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 13.0 t-105 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.697 0.284 . . . . 71.22 110.908 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -60.24 -35.27 75.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.301 -0.409 . . . . 72.51 110.869 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.94 -36.63 84.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.151 -0.477 . . . . 74.32 110.905 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.13 -35.85 69.97 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.257 -0.429 . . . . 74.22 111.112 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -72.49 -42.95 64.32 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.222 -0.444 . . . . 73.12 110.91 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.68 -32.64 74.08 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.201 -0.454 . . . . 72.4 110.938 179.91 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -70.02 -41.87 73.74 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 75.11 110.933 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.407 ' HA ' ' HB2' ' A' ' 22' ' ' PHE . 6.5 mt -71.64 -32.82 68.37 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.131 -0.486 . . . . 75.43 110.841 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.437 ' HE2' ' HA ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -57.04 -37.53 71.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.217 -0.447 . . . . 75.45 110.885 179.918 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.437 ' HA ' ' HE2' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -85.01 -26.62 26.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.201 -0.454 . . . . 74.22 110.869 179.968 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.407 ' HB2' ' HA ' ' A' ' 19' ' ' LEU . 1.5 m-85 -59.53 -38.6 81.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.147 -0.478 . . . . 75.2 110.852 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 2.4 p90 . . . . . 0 C--N 1.328 -0.346 0 CA-C-N 116.189 -0.46 . . . . 74.4 110.936 -179.868 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.583 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 32.5 tp . . . . . 0 C--O 1.23 0.062 0 CA-C-O 120.794 0.331 . . . . 74.54 110.927 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -57.14 -51.11 70.61 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.127 -0.488 . . . . 73.13 110.858 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.65 -36.33 83.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.172 -0.467 . . . . 71.12 111.153 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -66.51 -49.07 67.75 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.16 -0.473 . . . . 74.43 110.945 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.583 ' HG ' ' O ' ' A' ' 35' ' ' LEU . 11.3 mt -54.62 -38.2 66.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.268 -0.424 . . . . 74.44 110.925 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.7 mmmt -59.44 -45.87 90.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.159 -0.473 . . . . 74.2 110.877 179.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -69.91 -33.78 72.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.203 -0.453 . . . . 75.11 110.9 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -68.47 -46.86 68.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.111 -0.495 . . . . 63.43 110.902 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -57.66 -40.34 79.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.27 -0.423 . . . . 75.32 110.941 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.0 mmpt? -69.82 -25.7 63.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.255 -0.429 . . . . 75.11 110.877 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -70.08 -36.07 74.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.241 -0.436 . . . . 73.32 110.89 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 28.2 m-85 -80.49 -27.17 37.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.146 -0.479 . . . . 70.43 110.882 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . 0.404 ' HA2' ' HB2' ' A' ' 206' ' ' SER . . . 102.53 -10.3 56.15 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.716 -0.754 . . . . 64.42 112.479 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.402 HD13 HG13 ' A' ' 50' ' ' ILE . 0.8 OUTLIER -65.56 140.52 97.57 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.566 0.698 . . . . 74.31 110.899 -179.927 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -69.73 -54.4 0.22 Allowed 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.662 2.241 . . . . 74.5 112.435 179.79 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.402 HG13 HD13 ' A' ' 48' ' ' LEU . 0.8 OUTLIER -50.4 108.25 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.189 -0.46 . . . . 72.24 111.166 179.865 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 73.6 p -121.96 159.04 27.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.189 -0.46 . . . . 73.25 111.178 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 82.92 -10.69 56.87 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.79 -0.719 . . . . 64.24 112.439 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 30.5 mtp -135.22 161.12 36.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.808 0.337 . . . . 75.23 110.842 -179.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.433 ' HA ' ' HB ' ' A' ' 58' ' ' VAL . 1.4 pp -160.15 129.42 5.09 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.192 -0.458 . . . . 74.32 110.967 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 p30 172.0 -29.04 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.193 -0.458 . . . . 61.31 110.924 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 2.7 m -97.54 -85.38 0.36 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.188 -0.46 . . . . 75.25 110.806 -179.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 18.6 tpt180 -84.46 -39.34 19.05 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.12 -0.491 . . . . 74.13 110.859 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.433 ' HB ' ' HA ' ' A' ' 54' ' ' LEU . 15.8 t -59.01 -43.94 90.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.261 -0.427 . . . . 72.2 111.064 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -74.38 -31.17 27.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.23 -0.441 . . . . 75.2 111.133 179.898 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.77 -33.06 71.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.465 . . . . 73.45 110.872 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.427 HG12 ' O ' ' A' ' 58' ' ' VAL . 0.6 OUTLIER -69.94 -29.68 41.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.137 -0.483 . . . . 74.52 111.128 -179.956 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 10.8 mtt -68.04 -35.17 77.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.178 -0.465 . . . . 74.01 110.888 179.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -86.9 -24.05 24.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.234 -0.439 . . . . 45.15 110.912 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.31 123.26 73.35 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.639 0.733 . . . . 75.32 110.801 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.77 147.2 62.27 Favored 'Trans proline' 0 N--CA 1.465 -0.181 0 C-N-CA 122.693 2.262 . . . . 72.11 112.373 179.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -150.4 -76.34 0.15 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.245 -0.434 . . . . 73.22 110.88 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -144.94 153.94 42.06 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.166 -0.47 . . . . 72.31 110.874 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.53 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -103.97 24.07 30.47 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.736 -0.745 . . . . 64.23 112.501 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -104.96 136.71 19.13 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 121.65 0.738 . . . . 74.23 111.063 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 162.21 42.92 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.683 2.255 . . . . 63.44 112.333 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -128.59 43.03 3.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.206 -0.452 . . . . 74.45 110.842 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.178 -0.464 . . . . 73.52 111.115 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo . . . . . 0 C--O 1.231 0.172 0 CA-C-O 120.864 0.277 . . . . 72.25 112.306 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 2.3 mttp -77.72 171.4 15.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.239 -0.437 . . . . 72.53 110.922 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . 0.417 ' CD1' ' HA ' ' A' ' 200' ' ' LEU . 75.9 m95 -66.38 134.84 53.39 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.23 -0.441 . . . . 73.31 110.9 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 5.5 t -115.26 1.36 13.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.259 -0.428 . . . . 71.34 111.172 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -74.95 -178.85 3.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.252 -0.431 . . . . 73.12 110.842 -179.881 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 15.2 mttt -103.08 -8.78 20.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.136 -0.484 . . . . 71.12 110.861 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -153.54 144.92 14.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.258 -0.428 . . . . 74.14 111.097 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 97.4 t -123.62 130.34 74.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.171 -0.468 . . . . 72.25 111.118 179.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -116.2 156.34 26.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.164 -0.471 . . . . 75.51 111.097 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 4.8 p90 -147.09 146.84 30.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.254 -0.43 . . . . 70.51 110.967 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -151.15 135.56 16.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.1 -0.5 . . . . 74.3 110.832 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 13.7 mm -75.27 131.67 34.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.185 -0.461 . . . . 72.4 111.144 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 16.4 t -88.34 -40.21 13.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.462 . . . . 74.41 111.1 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 3.4 t -151.46 169.63 21.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.186 -0.461 . . . . 64.24 110.803 -179.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 11.5 p90 -130.16 154.16 47.8 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.124 -0.489 . . . . 74.1 110.909 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 3.4 t -102.3 141.64 34.8 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.099 -0.5 . . . . 75.33 111.109 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 4.8 mmp_? -52.63 -17.95 1.54 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.187 -0.46 . . . . 72.14 110.937 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.88 -36.87 85.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.156 -0.475 . . . . 74.13 110.862 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.7 mp -143.13 152.11 57.27 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-O 121.617 0.722 . . . . 72.52 110.932 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . 0.407 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.9 Cg_endo -69.71 151.03 69.27 Favored 'Trans proline' 0 C--O 1.233 0.226 0 C-N-CA 122.694 2.262 . . . . 73.11 112.38 179.866 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 3.3 t-160 -52.96 -26.59 15.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.251 -0.431 . . . . 74.11 110.91 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.407 HG22 ' HB2' ' A' ' 101' ' ' PRO . 0.0 OUTLIER -76.46 -39.23 33.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.178 -0.464 . . . . 74.02 111.078 -179.999 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 3.0 m -69.47 -39.67 77.56 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.146 -0.479 . . . . 54.24 111.11 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 72.4 t -72.74 -46.37 53.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.302 -0.408 . . . . 73.13 111.114 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.6 ' O ' HG21 ' A' ' 109' ' ' VAL . 59.7 t0 -58.45 -45.53 88.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.17 -0.468 . . . . 63.44 110.845 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 12.2 ptm180 -70.39 -34.08 72.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.222 -0.445 . . . . 75.02 110.797 -179.785 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.548 ' HB3' ' HD2' ' A' ' 188' ' ' PHE . 0.0 OUTLIER -60.87 -48.68 80.69 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.234 -0.439 . . . . 75.05 110.97 -179.999 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.6 HG21 ' O ' ' A' ' 106' ' ' ASP . 1.5 m -55.33 -41.47 61.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.152 -0.476 . . . . 72.31 111.11 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.462 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 47.0 t -70.11 -33.35 71.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.15 -0.477 . . . . 72.14 110.81 -179.775 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -61.56 -32.92 73.02 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.165 -0.47 . . . . 74.35 110.864 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.81 -40.15 9.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.246 -0.434 . . . . 74.32 111.134 179.773 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -65.1 -33.4 75.94 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.218 -0.446 . . . . 74.11 110.884 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -70.45 -42.63 71.26 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.208 -0.451 . . . . 75.15 110.884 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.5 -34.75 69.4 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.18 -0.464 . . . . 74.0 110.818 179.926 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 14.6 m95 -61.46 -50.12 74.04 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.252 -0.431 . . . . 75.23 110.906 -179.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' GLY . . . . . 0.596 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -73.08 -27.48 68.41 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.768 -0.73 . . . . 73.44 112.406 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.2 mmpt? -63.22 -15.18 56.23 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.791 0.329 . . . . 74.42 110.928 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . 0.434 ' HG2' HD13 ' A' ' 226' ' ' LEU . 0.4 OUTLIER -107.57 14.08 26.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.189 -0.46 . . . . 75.55 110.862 -179.985 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . 0.596 ' CG1' ' HA2' ' A' ' 117' ' ' GLY . 7.3 pt -147.08 155.64 47.06 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 121.668 0.747 . . . . 71.34 111.101 -180.0 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.76 3.7 2.62 Favored 'Trans proline' 0 C--N 1.342 0.226 0 C-N-CA 122.633 2.222 . . . . 75.35 112.391 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.43 ' HB3' ' H ' ' A' ' 123' ' ' HIS . 4.6 mt -60.59 -155.37 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.232 -0.44 . . . . 73.22 110.981 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . 0.43 ' H ' ' HB3' ' A' ' 122' ' ' LEU . 65.9 t60 -167.81 149.0 5.31 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.266 -0.424 . . . . 74.12 110.86 179.87 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 43.9 m-85 -129.41 148.67 51.35 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.223 -0.444 . . . . 75.54 110.841 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . 0.407 ' HG2' ' N ' ' A' ' 126' ' ' LYS . 0.4 OUTLIER -126.22 143.19 51.23 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.13 -0.487 . . . . 75.14 110.919 -179.971 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . 0.407 ' N ' ' HG2' ' A' ' 125' ' ' ARG . 0.0 OUTLIER -80.7 140.34 35.65 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.201 -0.454 . . . . 74.04 110.875 -179.999 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 16.6 m -102.85 129.81 53.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.468 . . . . 50.13 111.082 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -142.31 -22.61 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.156 -0.475 . . . . 74.43 111.127 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -139.01 109.18 6.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.146 -0.479 . . . . 73.32 110.88 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 108.43 -160.73 13.61 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.711 -0.757 . . . . 62.11 112.466 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -102.0 155.56 18.09 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.795 0.331 . . . . 71.11 111.139 -179.862 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -112.23 165.47 12.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.201 -0.454 . . . . 72.32 111.057 179.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -71.53 -58.22 3.7 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.176 -0.466 . . . . 75.41 110.842 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 16.8 mm -85.11 107.96 16.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.226 -0.443 . . . . 71.04 111.123 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 8.4 mmm -95.29 121.0 36.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.152 -0.477 . . . . 72.43 110.869 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -106.9 97.79 6.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.306 -0.407 . . . . 70.04 111.099 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -129.36 165.96 21.83 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.725 -0.75 . . . . 63.34 112.533 179.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 82.4 m-85 -105.27 141.45 36.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.859 0.362 . . . . 74.01 110.893 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . 170.24 165.84 0.06 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.119 -0.491 . . . . 71.21 111.092 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . 0.404 ' HB2' ' HB3' ' A' ' 149' ' ' PHE . 7.2 ptt180 -105.99 174.08 6.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.194 -0.457 . . . . 72.34 110.849 -179.888 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . 0.458 ' H ' ' HA ' ' A' ' 149' ' ' PHE . . . -55.71 -16.76 12.44 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.716 -0.754 . . . . 74.24 112.46 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -91.84 13.12 19.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.86 0.362 . . . . 75.03 111.117 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 4.3 p80 -79.21 -2.07 39.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.199 -0.455 . . . . 73.45 110.86 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 107.92 49.1 0.85 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.751 -0.738 . . . . 60.43 112.523 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -163.59 174.59 11.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.848 0.356 . . . . 72.14 110.802 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 47.1 p -63.9 -179.61 0.42 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.172 -0.467 . . . . 64.54 110.853 -179.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 65.34 119.97 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.627 0.727 . . . . 73.4 110.955 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.8 141.41 45.02 Favored 'Trans proline' 0 C--O 1.232 0.186 0 C-N-CA 122.734 2.29 . . . . 74.53 112.328 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 149' ' ' PHE . . . . . 0.482 ' O ' ' CG ' ' A' ' 150' ' ' ASP . 3.4 p90 -54.23 -40.71 67.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.275 -0.421 . . . . 70.0 110.879 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . 0.482 ' CG ' ' O ' ' A' ' 149' ' ' PHE . 2.8 p30 49.16 19.19 0.28 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.106 -0.497 . . . . 72.24 110.891 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . 0.423 ' C ' ' O ' ' A' ' 150' ' ' ASP . . . 35.97 -147.53 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.785 -0.721 . . . . 75.42 112.495 -179.942 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.68 145.27 57.09 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.721 2.28 . . . . 75.11 112.325 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . 0.456 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 106.45 -138.99 14.67 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.803 -0.713 . . . . 70.32 112.52 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 154' ' ' ASN . . . . . 0.456 ' C ' ' O ' ' A' ' 153' ' ' GLY . 3.7 p30 -33.8 136.05 0.12 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.896 0.379 . . . . 74.45 110.88 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 77.19 115.91 0.06 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.2 -0.455 . . . . 63.14 111.114 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 156' ' ' LEU . . . . . 0.483 HD13 HG13 ' A' ' 186' ' ' ILE . 0.6 OUTLIER -94.53 -53.39 3.92 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.209 -0.45 . . . . 75.02 110.894 179.961 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . 0.53 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -163.97 149.32 10.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.178 -0.464 . . . . 73.44 111.069 179.818 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 29.3 p-80 -109.13 123.6 49.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.256 -0.429 . . . . 74.34 110.903 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -110.54 152.6 26.19 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.248 -0.433 . . . . 74.42 111.067 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -108.01 169.85 8.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.191 -0.459 . . . . 75.31 110.862 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -107.98 164.23 15.23 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-O 121.624 0.726 . . . . 71.14 111.149 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.86 90.06 0.53 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.688 2.259 . . . . 74.44 112.315 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -144.43 141.72 10.36 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.779 -0.724 . . . . 72.32 112.514 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 74.3 m 64.79 -81.31 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.82 0.343 . . . . 73.1 111.135 -179.834 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -179.52 -70.19 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.721 -0.752 . . . . 74.03 112.489 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 166' ' ' LEU . . . . . 0.536 ' CD2' ' C ' ' A' ' 166' ' ' LEU . 0.0 OUTLIER -54.0 -21.57 8.49 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.815 0.341 . . . . 75.02 110.848 -179.9 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . 0.452 ' H ' HD12 ' A' ' 166' ' ' LEU . . . -80.38 -173.84 46.91 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.732 -0.747 . . . . 43.43 112.543 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 72.8 22.26 79.18 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.775 -0.726 . . . . 74.31 112.444 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -95.93 -174.21 3.05 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.798 0.333 . . . . 63.41 110.858 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -124.71 131.42 53.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.128 -0.487 . . . . 74.21 111.064 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 18.8 m170 -125.92 132.37 52.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.206 -0.452 . . . . 72.53 110.882 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 -114.35 140.26 48.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.195 -0.457 . . . . 71.44 110.911 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 57.8 t0 -73.43 101.59 3.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.138 -0.483 . . . . 74.11 110.881 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.34 -16.21 13.51 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.16 -0.473 . . . . 74.45 110.876 -179.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -79.11 -16.16 57.1 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.123 -0.49 . . . . 73.32 110.796 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 37.8 mm-40 -83.61 -175.88 6.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.262 -0.427 . . . . 71.41 110.922 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 54.4 mtm180 -111.59 116.86 31.52 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.225 -0.443 . . . . 74.32 110.881 -179.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 52.1 m95 -116.96 139.89 50.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.203 -0.453 . . . . 74.32 110.959 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 12.7 t -178.11 163.5 1.71 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.236 -0.438 . . . . 74.13 111.142 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -125.32 -70.13 0.76 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.29 -0.413 . . . . 61.52 110.946 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -62.83 -13.57 47.67 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.784 -0.722 . . . . 62.41 112.5 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 182' ' ' SER . . . . . 0.422 ' O ' ' C ' ' A' ' 183' ' ' SER . 0.4 OUTLIER -93.58 -24.41 17.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.859 0.361 . . . . 74.0 110.806 -179.677 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 183' ' ' SER . . . . . 0.422 ' C ' ' O ' ' A' ' 182' ' ' SER . 4.5 m 35.67 57.61 0.9 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.127 -0.488 . . . . 64.12 110.824 -179.776 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 4.2 tt -116.86 -33.62 4.72 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.124 -0.489 . . . . 74.43 110.837 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -117.99 -140.22 6.43 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.809 -0.71 . . . . 74.22 112.528 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 186' ' ' ILE . . . . . 0.483 HG13 HD13 ' A' ' 156' ' ' LEU . 5.5 mm -79.65 98.58 3.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 120.873 0.368 . . . . 73.22 111.149 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -47.09 120.52 3.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.15 -0.477 . . . . 71.31 110.892 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 188' ' ' PHE . . . . . 0.548 ' HD2' ' HB3' ' A' ' 108' ' ' LEU . 1.4 t80 -54.07 -35.41 62.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.137 -0.483 . . . . 75.45 110.902 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.11 -48.0 69.47 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.077 -0.51 . . . . 60.14 110.946 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -70.22 -40.23 74.63 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.152 -0.476 . . . . 74.22 110.906 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -70.62 -35.07 72.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.143 -0.48 . . . . 61.32 111.08 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 192' ' ' ALA . . . . . 0.528 ' O ' ' HB2' ' A' ' 196' ' ' LEU . . . -56.62 -44.62 81.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.246 -0.433 . . . . 52.32 111.114 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.47 -42.37 87.34 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.285 -0.416 . . . . 72.43 111.109 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 14.5 t-160 -73.36 -42.06 62.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.263 -0.426 . . . . 71.44 110.755 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -72.09 -48.59 42.91 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.299 -0.409 . . . . 71.01 111.132 179.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 196' ' ' LEU . . . . . 0.528 ' HB2' ' O ' ' A' ' 192' ' ' ALA . 4.4 mm? -65.73 -43.45 88.99 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.218 -0.447 . . . . 74.52 110.965 -179.955 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -57.34 -28.37 59.04 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.68 -0.771 . . . . 62.43 112.527 179.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 198' ' ' HIS . . . . . . . . . . . . . 6.1 m-70 -65.87 -32.84 74.58 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.777 0.322 . . . . 75.21 110.88 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -69.77 -20.84 63.47 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.265 -0.425 . . . . 73.13 110.847 -179.802 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 200' ' ' LEU . . . . . 0.417 ' HA ' ' CD1' ' A' ' 84' ' ' TRP . 0.3 OUTLIER -89.78 5.56 45.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.139 -0.482 . . . . 75.12 110.916 -179.98 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 83.6 -7.52 68.82 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.704 -0.76 . . . . 50.41 112.577 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 202' ' ' MET . . . . . . . . . . . . . 45.4 tpp -55.27 135.24 49.99 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.797 0.332 . . . . 71.04 110.853 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -113.53 158.94 13.97 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.75 -0.738 . . . . 64.44 112.465 -179.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 11.2 m170 -55.15 150.76 10.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.793 0.33 . . . . 74.32 110.86 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -117.51 162.57 17.76 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.149 -0.478 . . . . 72.42 110.84 -179.751 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 206' ' ' SER . . . . . 0.404 ' HB2' ' HA2' ' A' ' 47' ' ' GLY . 2.0 p -88.36 -4.0 58.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.089 -0.505 . . . . 72.22 110.879 -179.803 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -70.89 134.89 85.58 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.645 0.736 . . . . 65.11 110.825 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.85 -6.1 17.85 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.631 2.22 . . . . 74.53 112.362 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 -126.65 33.42 4.97 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.217 -0.447 . . . . 63.52 110.902 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 210' ' ' ALA . . . . . 0.439 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.28 145.77 26.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.148 -0.478 . . . . 64.4 111.063 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -73.31 -25.91 21.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.222 -0.445 . . . . 75.23 111.122 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -99.68 8.7 44.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.222 -0.444 . . . . 75.22 110.849 179.908 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 213' ' ' TYR . . . . . 0.431 ' CD1' ' HD2' ' A' ' 214' ' ' PRO . 0.3 OUTLIER -55.31 128.13 66.21 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.679 0.752 . . . . 73.43 110.955 -179.927 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 214' ' ' PRO . . . . . 0.431 ' HD2' ' CD1' ' A' ' 213' ' ' TYR . 54.2 Cg_endo -69.72 -18.54 37.13 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.738 2.292 . . . . 63.01 112.417 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 215' ' ' THR . . . . . 0.402 ' OG1' ' CD2' ' A' ' 213' ' ' TYR . 2.2 p -84.38 48.3 1.48 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.153 -0.476 . . . . 74.24 111.146 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 10.9 t80 . . . . . 0 C--N 1.327 -0.392 0 CA-C-N 116.235 -0.439 . . . . 74.42 110.959 -179.95 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.888 0.375 . . . . 71.11 110.899 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.64 159.61 42.15 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.182 -0.463 . . . . 65.02 110.919 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 226' ' ' LEU . . . . . 0.434 HD13 ' HG2' ' A' ' 119' ' ' GLU . 24.6 mt -60.21 149.12 34.05 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.287 -0.415 . . . . 62.53 110.882 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 227' ' ' SER . . . . . 0.439 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 1.0 OUTLIER -86.78 152.25 22.67 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.23 -0.441 . . . . 74.21 110.9 -179.927 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -65.19 -68.31 0.37 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.171 -0.468 . . . . 74.54 110.925 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -55.38 -24.97 32.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.174 -0.466 . . . . 74.2 110.826 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 4.9 t0 -69.51 -49.24 56.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.176 -0.465 . . . . 74.23 110.895 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 231' ' ' ILE . . . . . 0.413 HG12 ' HG2' ' A' ' 119' ' ' GLU . 9.2 mt -68.56 -42.63 83.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.203 -0.453 . . . . 73.41 111.211 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 232' ' ' LYS . . . . . 0.425 ' HG3' ' N ' ' A' ' 233' ' ' GLY . 0.2 OUTLIER -59.7 -32.08 70.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.084 -0.507 . . . . 73.32 110.915 179.844 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 233' ' ' GLY . . . . . 0.425 ' N ' ' HG3' ' A' ' 232' ' ' LYS . . . -69.02 -47.11 56.36 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.717 -0.754 . . . . 65.45 112.546 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 13.5 tt -72.59 -30.64 34.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.81 0.338 . . . . 74.41 111.147 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -66.82 -24.56 66.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.108 -0.496 . . . . 71.13 110.975 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 236' ' ' LYS . . . . . 0.469 ' HE3' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.16 -23.1 59.2 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.174 -0.466 . . . . 74.41 110.918 179.929 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 237' ' ' LEU . . . . . 0.469 ' HB2' ' HE3' ' A' ' 236' ' ' LYS . 10.5 tt -97.24 -38.41 9.69 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.202 -0.454 . . . . 75.41 110.926 179.869 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 238' ' ' TYR . . . . . . . . . . . . . 62.7 m-85 -92.35 -2.66 56.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 54.42 110.914 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.302 0 C-N-CA 120.734 -0.746 . . . . 72.22 112.431 179.946 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 19.0 t-105 . . . . . 0 C--O 1.23 0.057 0 CA-C-O 120.745 0.307 . . . . 71.22 110.958 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 62.5 mt-10 -73.41 -35.47 65.85 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.214 -0.448 . . . . 72.51 110.886 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -63.0 -40.97 99.39 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.139 -0.482 . . . . 74.32 110.939 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.78 -41.86 98.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.192 -0.458 . . . . 74.22 111.057 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -66.06 -43.15 88.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 73.12 110.9 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -71.07 -31.48 67.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.173 -0.467 . . . . 72.4 110.893 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -70.22 -35.8 74.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.149 -0.478 . . . . 75.11 110.917 -179.805 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -67.21 -26.24 66.51 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.162 -0.472 . . . . 75.43 110.921 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 6.3 ptmt -69.43 -32.64 71.73 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.145 -0.48 . . . . 75.45 110.895 179.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.3 ptp180 -86.75 -27.62 23.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.213 -0.449 . . . . 74.22 110.905 179.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.95 -24.29 64.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.162 -0.472 . . . . 75.2 110.955 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.518 ' O ' ' HB3' ' A' ' 70' ' ' PRO . 19.2 m-85 . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.123 -0.489 . . . . 74.4 110.916 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.76 0.315 . . . . 74.54 110.953 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -64.25 -51.34 64.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.21 -0.45 . . . . 73.13 110.886 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.82 -47.85 81.63 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.101 -0.5 . . . . 71.12 111.064 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 2.4 tttp -60.17 -38.62 83.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.281 -0.418 . . . . 74.43 110.931 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -54.6 -36.68 64.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.208 -0.451 . . . . 74.44 110.911 179.902 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.1 ttpp -58.89 -45.72 89.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.183 -0.462 . . . . 74.2 110.914 179.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -69.79 -37.34 76.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.22 -0.446 . . . . 75.11 110.908 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 6.7 ttt -68.6 -40.29 80.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.106 -0.497 . . . . 63.43 110.907 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -65.94 -42.36 90.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.241 -0.436 . . . . 75.32 110.889 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.0 mmpt? -63.37 -28.47 70.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.171 -0.468 . . . . 75.11 110.876 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 15.0 t80 -69.8 -36.84 76.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.218 -0.447 . . . . 73.32 110.915 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -81.2 -35.24 31.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.165 -0.471 . . . . 70.43 110.907 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 102.79 -6.11 51.6 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.733 -0.746 . . . . 64.42 112.465 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.413 HD12 HG13 ' A' ' 50' ' ' ILE . 0.6 OUTLIER -59.71 143.13 87.3 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.593 0.711 . . . . 74.31 110.962 -179.932 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.66 -53.92 0.25 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.712 2.275 . . . . 74.5 112.358 179.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.413 HG13 HD12 ' A' ' 48' ' ' LEU . 0.7 OUTLIER -51.58 108.09 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.146 -0.479 . . . . 72.24 111.157 179.939 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -109.61 160.63 16.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.257 -0.429 . . . . 73.25 111.128 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 57.67 18.51 31.61 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.815 -0.707 . . . . 64.24 112.483 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 10.1 mtt -124.76 161.14 27.07 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.753 0.311 . . . . 75.23 110.885 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 20.1 tp -157.87 96.5 1.49 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.186 -0.461 . . . . 74.32 110.855 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 174.77 -29.06 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.192 -0.458 . . . . 61.31 110.87 179.892 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 2.5 p -85.08 -99.63 0.06 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.155 -0.475 . . . . 75.25 110.876 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -84.84 -30.5 24.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.139 -0.482 . . . . 74.13 110.866 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 41.9 t -59.33 -43.75 90.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.193 -0.458 . . . . 72.2 111.144 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 2.9 mm -75.05 -31.33 24.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.172 -0.467 . . . . 75.2 111.1 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -66.1 -44.21 85.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.165 -0.471 . . . . 73.45 110.869 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 35.5 pt -66.29 -29.78 47.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.115 -0.493 . . . . 74.52 111.143 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 1.4 mmm -71.18 -33.2 69.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.166 -0.47 . . . . 74.01 110.885 179.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -88.09 -25.66 22.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.199 -0.455 . . . . 45.15 110.896 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.01 137.69 37.47 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.573 0.702 . . . . 75.32 110.897 179.999 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -69.79 113.2 3.3 Favored 'Trans proline' 0 C--O 1.232 0.217 0 C-N-CA 122.66 2.24 . . . . 72.11 112.349 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 4.6 ttm180 -106.87 -85.75 0.5 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.296 -0.411 . . . . 73.22 110.873 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -145.86 156.31 43.47 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.19 -0.459 . . . . 72.31 110.848 -179.929 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.544 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -96.63 16.78 60.43 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.739 -0.743 . . . . 64.23 112.468 -179.924 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -111.85 133.15 21.66 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.604 0.716 . . . . 74.23 111.091 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . 0.518 ' HB3' ' O ' ' A' ' 23' ' ' TYR . 54.1 Cg_endo -69.7 165.73 29.92 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.66 2.24 . . . . 63.44 112.367 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -120.52 38.51 3.98 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.234 -0.439 . . . . 74.45 110.859 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.167 -0.47 . . . . 73.52 111.102 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo . . . . . 0 C--O 1.232 0.191 0 CA-C-O 120.859 0.275 . . . . 72.25 112.332 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.479 ' HD2' ' CD2' ' A' ' 237' ' ' LEU . 0.3 OUTLIER -89.61 165.34 14.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.237 -0.438 . . . . 72.53 110.855 179.929 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . 0.486 ' CD1' ' HA ' ' A' ' 200' ' ' LEU . 24.5 m95 -55.86 123.57 14.69 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.153 -0.476 . . . . 73.31 110.91 179.868 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -115.16 1.35 13.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.243 -0.435 . . . . 71.34 111.109 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -69.63 163.25 25.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.198 -0.455 . . . . 73.12 110.849 -179.874 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.92 -7.21 57.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.153 -0.476 . . . . 71.12 110.837 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -172.76 139.21 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.231 -0.441 . . . . 74.14 111.197 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 13.3 t -122.51 129.59 75.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 72.25 111.091 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 5.0 p -116.99 168.22 10.44 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.169 -0.468 . . . . 75.51 111.144 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.413 ' CD1' ' N ' ' A' ' 91' ' ' TYR . 2.5 p90 -145.26 146.56 31.72 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.259 -0.428 . . . . 70.51 110.909 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.409 ' HB2' ' HB2' ' A' ' 132' ' ' ALA . 3.4 ttt180 -147.04 132.09 18.23 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.148 -0.478 . . . . 74.3 110.831 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.4 HD11 ' HA ' ' A' ' 106' ' ' ASP . 3.9 mp -74.67 134.97 28.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.155 -0.475 . . . . 72.4 111.113 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.409 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 11.2 t -93.96 -40.63 11.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.198 -0.456 . . . . 74.41 111.163 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 1.4 t -139.45 164.03 30.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.136 -0.484 . . . . 64.24 110.881 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 11.2 p90 -113.54 152.52 30.12 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.115 -0.493 . . . . 74.1 110.911 -179.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' THR . . . . . 0.419 ' O ' ' O ' ' A' ' 100' ' ' LEU . 0.2 OUTLIER -82.74 141.02 32.7 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.126 -0.488 . . . . 75.33 111.119 -179.931 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 4.4 ppt_? -74.15 -7.08 51.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.243 -0.435 . . . . 72.14 110.868 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -96.4 -26.47 15.32 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.181 -0.463 . . . . 74.13 110.82 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.419 ' O ' ' O ' ' A' ' 97' ' ' THR . 0.6 OUTLIER -133.84 153.68 80.06 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-O 121.543 0.687 . . . . 72.52 110.954 -179.928 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . 0.416 ' HB2' HG23 ' A' ' 103' ' ' ILE . 53.9 Cg_endo -69.76 150.89 68.82 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.696 2.264 . . . . 73.11 112.322 179.82 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 16.0 t-160 -52.22 -26.21 11.14 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.138 -0.483 . . . . 74.11 110.825 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.416 HG23 ' HB2' ' A' ' 101' ' ' PRO . 13.9 tt -76.8 -39.2 30.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.199 -0.455 . . . . 74.02 111.122 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 3.4 m -69.46 -38.56 77.81 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.141 -0.481 . . . . 54.24 111.141 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 98.7 t -72.7 -45.08 58.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.275 -0.421 . . . . 73.13 111.152 179.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.589 ' O ' HG22 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -64.72 -42.42 95.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.21 -0.45 . . . . 63.44 110.823 179.931 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 13.8 ptm180 -70.14 -34.06 72.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.179 -0.464 . . . . 75.02 110.835 -179.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.551 ' HB3' ' HD2' ' A' ' 188' ' ' PHE . 0.0 OUTLIER -61.0 -48.84 79.95 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.221 -0.445 . . . . 75.05 110.961 179.95 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.589 HG22 ' O ' ' A' ' 106' ' ' ASP . 1.4 m -55.78 -41.66 66.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.204 -0.453 . . . . 72.31 111.082 179.867 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.471 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 13.5 t -70.1 -34.29 72.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.19 -0.459 . . . . 72.14 110.845 -179.841 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -62.44 -33.53 75.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.164 -0.471 . . . . 74.35 110.928 179.912 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -94.68 -40.2 9.93 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.165 -0.47 . . . . 74.32 111.068 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.86 -33.11 75.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.224 -0.444 . . . . 74.11 110.926 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -65.68 -36.4 83.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.164 -0.471 . . . . 75.15 110.887 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.58 -34.48 78.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.174 -0.466 . . . . 74.0 110.892 179.932 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' TRP . . . . . 0.619 ' O ' ' HG3' ' A' ' 119' ' ' GLU . 6.9 m95 -64.24 -49.48 71.77 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.199 -0.455 . . . . 75.23 110.946 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' GLY . . . . . 0.568 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -74.79 -19.41 79.92 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.802 -0.713 . . . . 73.44 112.45 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 5.6 mtmt -70.53 -14.01 62.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.739 0.304 . . . . 74.42 110.933 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . 0.619 ' HG3' ' O ' ' A' ' 116' ' ' TRP . 2.3 pp20? -109.97 12.45 23.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.243 -0.435 . . . . 75.55 110.877 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . 0.568 ' CG1' ' HA2' ' A' ' 117' ' ' GLY . 4.7 pt -144.25 142.98 20.69 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.64 0.733 . . . . 71.34 111.133 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 16.57 0.21 Allowed 'Trans proline' 0 C--O 1.233 0.268 0 C-N-CA 122.723 2.282 . . . . 75.35 112.33 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.476 ' H ' ' C ' ' A' ' 120' ' ' ILE . 5.2 mt -62.54 -158.07 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.301 -0.409 . . . . 73.22 110.908 -179.981 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . 0.467 ' H ' ' HB3' ' A' ' 122' ' ' LEU . 3.4 t-160 -156.47 121.06 4.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.196 -0.456 . . . . 74.12 110.886 179.796 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 11.6 m-30 -109.88 148.69 31.09 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.205 -0.452 . . . . 75.54 110.905 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.03 142.16 49.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.105 -0.498 . . . . 75.14 110.852 -179.878 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.03 149.35 30.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.187 -0.46 . . . . 74.04 110.957 179.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 26.5 m -103.13 126.14 57.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.195 -0.457 . . . . 50.13 111.087 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -142.98 -9.81 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.204 -0.453 . . . . 74.43 111.157 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -157.31 108.97 2.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.164 -0.471 . . . . 73.32 110.936 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 109.1 -159.7 13.93 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.727 -0.749 . . . . 62.11 112.512 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 23.7 p -101.96 156.11 17.74 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.821 0.343 . . . . 71.11 111.153 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . 0.409 ' HB2' ' HB2' ' A' ' 92' ' ' ARG . . . -111.97 165.32 12.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.26 -0.427 . . . . 72.32 111.06 179.873 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -70.03 -65.37 0.73 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.137 -0.483 . . . . 75.41 110.877 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 3.9 mp -88.71 106.74 17.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.218 -0.446 . . . . 71.04 111.145 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' MET . . . . . 0.409 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 0.9 OUTLIER -91.49 128.36 37.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.219 -0.446 . . . . 72.43 110.897 179.838 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -106.01 97.6 5.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.302 -0.408 . . . . 70.04 111.1 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -130.18 157.73 22.09 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.727 -0.749 . . . . 63.34 112.479 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 138' ' ' PHE . . . . . 0.42 ' O ' ' CB ' ' A' ' 139' ' ' ALA . 2.7 m-85 -105.12 147.5 27.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.88 0.371 . . . . 74.01 110.89 -179.844 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.42 ' CB ' ' O ' ' A' ' 138' ' ' PHE . . . 166.81 166.56 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.196 -0.456 . . . . 71.21 111.102 179.923 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 47.4 mtm180 -104.74 173.06 6.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.205 -0.452 . . . . 72.34 110.867 -179.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -55.02 -20.73 21.4 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.793 -0.718 . . . . 74.24 112.46 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -65.42 -13.57 59.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.818 0.342 . . . . 75.03 111.136 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 2.0 p80 -68.65 -11.13 59.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 73.45 110.917 179.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 116.06 39.41 0.88 Allowed Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.752 -0.737 . . . . 60.43 112.468 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -117.91 142.84 46.89 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.755 0.312 . . . . 72.14 110.838 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 52.8 p -65.28 153.73 40.24 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 64.54 110.883 -179.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 64.88 134.61 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.674 0.75 . . . . 73.4 110.912 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.67 134.62 28.61 Favored 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.7 2.267 . . . . 74.53 112.362 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 149' ' ' PHE . . . . . 0.403 ' CE1' ' HB2' ' A' ' 173' ' ' ASP . 0.1 OUTLIER -69.21 -32.22 71.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.288 -0.414 . . . . 70.0 110.862 179.956 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 74.23 -1.45 3.07 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.119 -0.491 . . . . 72.24 110.835 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 51.04 -111.12 1.16 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.737 -0.744 . . . . 75.42 112.474 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.8 139.96 41.36 Favored 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.641 2.227 . . . . 75.11 112.378 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 103.5 -154.38 17.96 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.744 -0.741 . . . . 70.32 112.445 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -41.41 153.17 0.05 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.875 0.369 . . . . 74.45 110.864 -179.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 77.31 108.07 0.08 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.236 -0.438 . . . . 63.14 111.136 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 156' ' ' LEU . . . . . 0.457 HD11 HG13 ' A' ' 186' ' ' ILE . 0.5 OUTLIER -90.83 -53.49 4.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 75.02 110.93 179.953 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . 0.544 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -165.44 148.14 7.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.133 -0.485 . . . . 73.44 111.067 179.809 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 20.0 p-80 -105.75 123.8 48.53 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.156 -0.475 . . . . 74.34 110.903 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -111.33 154.04 25.13 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.274 -0.421 . . . . 74.42 111.094 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 17.7 m-85 -106.8 146.99 30.22 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.202 -0.454 . . . . 75.31 110.845 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -78.47 164.51 55.67 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 121.631 0.729 . . . . 71.14 111.015 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 162' ' ' PRO . . . . . 0.406 ' HB3' ' CE2' ' A' ' 84' ' ' TRP . 53.3 Cg_endo -69.77 78.12 1.03 Allowed 'Trans proline' 0 C--N 1.343 0.237 0 C-N-CA 122.734 2.29 . . . . 74.44 112.299 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -137.81 114.62 1.11 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.692 -0.766 . . . . 72.32 112.447 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 66.64 168.39 0.23 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.864 0.364 . . . . 73.1 111.143 -179.875 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -64.64 -48.17 75.69 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.695 -0.764 . . . . 74.03 112.474 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 10.1 tt -62.7 -40.01 95.81 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.846 0.355 . . . . 75.02 110.916 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -79.35 163.16 48.45 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.739 -0.743 . . . . 43.43 112.454 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 89.88 22.72 35.12 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.686 -0.769 . . . . 74.31 112.457 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -91.98 161.65 14.71 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.769 0.319 . . . . 63.41 110.888 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.38 130.46 55.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.231 -0.441 . . . . 74.21 111.076 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 4.8 m170 -126.61 158.46 36.24 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.198 -0.455 . . . . 72.53 110.826 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 58.8 m-85 -140.93 138.84 34.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.151 -0.477 . . . . 71.44 110.868 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 173' ' ' ASP . . . . . 0.403 ' HB2' ' CE1' ' A' ' 149' ' ' PHE . 66.7 t0 -70.39 96.77 1.18 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.155 -0.475 . . . . 74.11 110.884 179.923 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 2.2 pp20? -57.87 -16.62 12.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.174 -0.467 . . . . 74.45 110.878 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -79.43 -16.4 56.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.145 -0.48 . . . . 73.32 110.814 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 25.1 mm-40 -79.78 -174.91 4.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.262 -0.426 . . . . 71.41 110.839 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 39.6 mtm180 -111.23 111.17 22.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.128 -0.487 . . . . 74.32 110.874 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 12.5 m95 -117.13 145.03 44.06 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.253 -0.43 . . . . 74.32 110.953 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 7.2 t -178.58 163.79 1.55 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.265 -0.425 . . . . 74.13 111.079 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -123.09 -68.21 0.9 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 61.52 110.902 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -66.99 -10.83 57.23 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.761 -0.733 . . . . 62.41 112.479 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 182' ' ' SER . . . . . 0.449 ' O ' ' C ' ' A' ' 183' ' ' SER . 0.3 OUTLIER -97.36 -24.44 15.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.763 0.316 . . . . 74.0 110.802 -179.71 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 183' ' ' SER . . . . . 0.449 ' C ' ' O ' ' A' ' 182' ' ' SER . 1.3 m 32.93 61.69 0.38 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.178 -0.465 . . . . 64.12 110.826 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -116.82 -33.66 4.72 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.196 -0.456 . . . . 74.43 110.928 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -121.66 -135.38 4.74 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.743 -0.742 . . . . 74.22 112.486 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 186' ' ' ILE . . . . . 0.457 HG13 HD11 ' A' ' 156' ' ' LEU . 8.5 mm -79.41 97.58 2.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.784 0.326 . . . . 73.22 111.113 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -50.87 123.46 9.18 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.193 -0.458 . . . . 71.31 110.846 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 188' ' ' PHE . . . . . 0.551 ' HD2' ' HB3' ' A' ' 108' ' ' LEU . 1.5 t80 -54.27 -36.55 63.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.144 -0.48 . . . . 75.45 110.821 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.43 -47.55 69.88 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.189 -0.459 . . . . 60.14 110.922 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 40.4 t80 -69.37 -39.28 78.15 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.222 -0.445 . . . . 74.22 110.874 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -71.64 -35.49 70.42 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.122 -0.49 . . . . 61.32 111.091 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 192' ' ' ALA . . . . . 0.482 ' O ' ' HB2' ' A' ' 196' ' ' LEU . . . -56.48 -44.91 81.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.214 -0.448 . . . . 52.32 111.103 179.905 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.4 -41.75 90.18 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.2 -0.455 . . . . 72.43 111.193 -179.88 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 18.1 t-160 -72.7 -39.7 66.78 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.195 -0.457 . . . . 71.44 110.843 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -75.02 -48.1 25.77 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.215 -0.448 . . . . 71.01 111.077 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 196' ' ' LEU . . . . . 0.482 ' HB2' ' O ' ' A' ' 192' ' ' ALA . 4.5 mm? -62.22 -39.04 91.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.199 -0.455 . . . . 74.52 110.885 -179.892 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -61.24 -26.54 66.18 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.736 -0.745 . . . . 62.43 112.485 179.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 198' ' ' HIS . . . . . . . . . . . . . 6.9 m-70 -70.06 -32.21 70.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.831 0.348 . . . . 75.21 110.856 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -71.72 -21.25 61.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.199 -0.455 . . . . 73.13 110.823 -179.754 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 200' ' ' LEU . . . . . 0.486 ' HA ' ' CD1' ' A' ' 84' ' ' TRP . 0.3 OUTLIER -93.08 -2.44 55.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.154 -0.475 . . . . 75.12 110.974 179.988 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 90.55 -9.5 77.41 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.731 -0.747 . . . . 50.41 112.509 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 202' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.91 129.41 26.8 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.82 0.343 . . . . 71.04 110.858 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -101.02 159.37 18.9 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.734 -0.746 . . . . 64.44 112.451 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 17.5 m-70 -55.93 167.38 0.6 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.774 0.321 . . . . 74.32 110.914 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -129.32 154.14 47.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.242 -0.435 . . . . 72.42 110.873 -179.731 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -87.55 -4.64 58.97 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.178 -0.464 . . . . 72.22 110.821 -179.794 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.72 136.99 82.86 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-O 121.614 0.721 . . . . 65.11 110.927 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 -6.33 18.34 Favored 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.688 2.259 . . . . 74.53 112.375 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -128.05 30.11 5.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.23 -0.441 . . . . 63.52 110.887 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 210' ' ' ALA . . . . . 0.424 ' HA ' ' HB2' ' A' ' 227' ' ' SER . . . -87.17 145.44 26.42 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.204 -0.453 . . . . 64.4 111.122 179.84 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -68.22 -28.53 41.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.256 -0.429 . . . . 75.23 111.167 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 11.0 mtp -97.91 10.52 40.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.134 -0.484 . . . . 75.22 110.897 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 213' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -55.56 114.35 7.17 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.638 0.732 . . . . 73.43 110.926 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 -18.36 36.96 Favored 'Trans proline' 0 C--O 1.232 0.209 0 C-N-CA 122.687 2.258 . . . . 63.01 112.316 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.24 52.29 2.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.23 -0.441 . . . . 74.24 111.068 -179.893 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 5.8 t80 . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 116.26 -0.427 . . . . 74.42 110.906 -179.972 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.956 0.408 . . . . 71.11 110.843 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -143.4 171.66 13.83 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.21 -0.45 . . . . 65.02 110.905 179.901 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 226' ' ' LEU . . . . . 0.41 HD12 ' HG2' ' A' ' 119' ' ' GLU . 25.5 mt -74.39 148.3 41.34 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.242 -0.435 . . . . 62.53 110.933 179.93 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 227' ' ' SER . . . . . 0.424 ' HB2' ' HA ' ' A' ' 210' ' ' ALA . 1.3 t -87.47 152.78 21.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.456 . . . . 74.21 110.873 -179.953 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 55.8 mt-30 -65.7 -64.77 0.78 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.137 -0.483 . . . . 74.54 110.928 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -55.85 -26.85 48.8 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 74.2 110.827 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -69.08 -50.06 51.69 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.192 -0.458 . . . . 74.23 110.901 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 231' ' ' ILE . . . . . . . . . . . . . 2.6 mm -69.93 -43.96 79.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.226 -0.443 . . . . 73.41 111.139 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 3.4 pttt -56.93 -32.69 66.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.168 -0.469 . . . . 73.32 110.847 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 233' ' ' GLY . . . . . 0.42 ' O ' ' HG3' ' A' ' 236' ' ' LYS . . . -65.52 -49.41 60.57 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.723 -0.751 . . . . 65.45 112.484 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 20.5 tt -73.77 -29.95 27.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.712 0.291 . . . . 74.41 111.075 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -62.3 -40.52 96.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.284 -0.417 . . . . 71.13 110.823 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 236' ' ' LYS . . . . . 0.428 ' HE2' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.24 -15.25 61.0 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.252 -0.431 . . . . 74.41 110.895 -179.99 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 237' ' ' LEU . . . . . 0.479 ' CD2' ' HD2' ' A' ' 83' ' ' LYS . 1.0 OUTLIER -96.57 -35.63 11.02 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.187 -0.46 . . . . 75.41 110.887 179.925 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 238' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -92.41 -35.58 13.6 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.221 -0.445 . . . . 54.42 110.911 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.32 0 C-N-CA 120.715 -0.755 . . . . 72.22 112.466 179.992 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 15.3 t-105 . . . . . 0 C--O 1.23 0.07 0 CA-C-O 120.672 0.273 . . . . 71.22 110.846 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -68.68 -35.46 77.24 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.282 -0.417 . . . . 72.51 110.939 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -62.94 -37.47 87.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.147 -0.479 . . . . 74.32 110.917 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.25 -40.15 77.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.209 -0.451 . . . . 74.22 111.087 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -70.98 -42.89 69.09 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 73.12 110.955 -179.91 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -67.44 -31.61 71.9 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.182 -0.463 . . . . 72.4 110.865 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 7.4 m-85 -66.53 -41.75 88.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.224 -0.444 . . . . 75.11 110.858 -179.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -71.36 -29.92 65.54 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.106 -0.497 . . . . 75.43 110.908 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.422 ' HE2' ' HA ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -61.44 -39.76 91.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.179 -0.464 . . . . 75.45 110.88 179.85 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.422 ' HA ' ' HE2' ' A' ' 20' ' ' LYS . 6.0 ptp180 -82.56 -27.72 31.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.226 -0.443 . . . . 74.22 110.911 179.957 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.0 m-30 -60.27 -15.87 28.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.189 -0.46 . . . . 75.2 110.897 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.176 -0.465 . . . . 74.4 110.925 -179.844 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.4 tt . . . . . 0 N--CA 1.458 -0.048 0 CA-C-O 120.783 0.325 . . . . 74.54 110.906 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.29 -51.41 63.65 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 73.13 110.817 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -55.3 -42.66 73.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.21 -0.45 . . . . 71.12 111.121 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.474 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.8 OUTLIER -70.38 -48.47 56.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.242 -0.436 . . . . 74.43 110.888 179.937 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.414 ' O ' ' HG2' ' A' ' 43' ' ' GLN . 4.3 mp -54.41 -37.29 64.91 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.258 -0.428 . . . . 74.44 110.945 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.6 tmmt? -58.63 -45.55 89.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.181 -0.463 . . . . 74.2 110.898 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.474 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 3.0 pt-20 -60.68 -32.79 71.98 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.225 -0.443 . . . . 75.11 110.849 -179.965 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 9.3 ttt -68.47 -33.72 74.67 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.143 -0.48 . . . . 63.43 110.909 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.436 ' HG3' ' HA ' ' A' ' 51' ' ' THR . 2.2 mm100 -61.63 -39.71 92.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.219 -0.446 . . . . 75.32 110.833 -179.888 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.2 mmpt? -71.6 -33.77 69.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.235 -0.439 . . . . 75.11 110.861 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 33.6 t80 -70.77 -40.26 72.75 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.231 -0.441 . . . . 73.32 110.94 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -81.76 -35.16 29.93 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.09 -0.505 . . . . 70.43 110.838 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 104.62 -10.08 49.05 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.719 -0.753 . . . . 64.42 112.469 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -62.37 134.54 94.9 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.661 0.743 . . . . 74.31 110.897 -179.902 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 -51.43 0.39 Allowed 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.627 2.218 . . . . 74.5 112.374 179.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -49.61 108.44 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.263 -0.426 . . . . 72.24 111.189 179.895 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.436 ' HA ' ' HG3' ' A' ' 43' ' ' GLN . 77.8 p -97.68 154.1 17.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.183 -0.462 . . . . 73.25 111.133 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 57.81 19.32 35.82 Favored Glycine 0 N--CA 1.453 -0.216 0 C-N-CA 120.724 -0.75 . . . . 64.24 112.445 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 12.8 mmt -101.43 161.12 13.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.811 0.338 . . . . 75.23 110.906 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.411 ' HA ' ' HB ' ' A' ' 58' ' ' VAL . 28.3 tp -172.21 84.66 0.07 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.215 -0.448 . . . . 74.32 110.884 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.3 t30 175.46 -28.86 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.134 -0.484 . . . . 61.31 110.88 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 30.9 t -89.42 -103.19 0.09 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.132 -0.486 . . . . 75.25 110.88 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.84 -25.12 28.28 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.182 -0.463 . . . . 74.13 110.956 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.442 ' O ' HG13 ' A' ' 61' ' ' ILE . 46.1 t -64.05 -42.15 94.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.166 -0.47 . . . . 72.2 111.141 179.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.9 mm -75.27 -31.66 24.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.162 -0.472 . . . . 75.2 111.117 179.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -59.69 -44.08 93.79 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.174 -0.466 . . . . 73.45 110.9 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.442 HG13 ' O ' ' A' ' 58' ' ' VAL . 1.4 pp -63.05 -29.48 47.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.142 -0.481 . . . . 74.52 111.164 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' MET . . . . . 0.408 ' N ' HG13 ' A' ' 61' ' ' ILE . 11.7 mmt -65.08 -36.73 85.24 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.207 -0.451 . . . . 74.01 110.808 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 15.8 pt20 -91.2 -26.25 19.14 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.306 -0.407 . . . . 45.15 110.877 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.16 125.4 70.3 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.548 0.69 . . . . 75.32 110.911 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.64 151.77 69.82 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.677 2.251 . . . . 72.11 112.351 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.14 -74.55 0.17 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.196 -0.457 . . . . 73.22 110.883 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 26.7 t -130.16 141.56 50.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.217 -0.447 . . . . 72.31 110.935 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.569 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -95.16 16.36 61.47 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.794 -0.717 . . . . 64.23 112.467 -179.909 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -125.63 145.4 51.26 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.57 0.7 . . . . 74.23 111.094 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.8 -179.85 3.22 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.727 2.285 . . . . 63.44 112.353 179.922 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -133.89 22.11 3.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.251 -0.431 . . . . 74.45 110.899 179.904 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.258 -0.428 . . . . 73.52 111.123 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo . . . . . 0 N--CA 1.465 -0.183 0 CA-C-O 120.867 0.278 . . . . 72.25 112.369 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.514 ' CG ' HD21 ' A' ' 237' ' ' LEU . 0.1 OUTLIER -88.83 150.48 22.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.189 -0.46 . . . . 72.53 110.883 179.925 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . 0.404 ' CD1' ' HA ' ' A' ' 200' ' ' LEU . 70.7 m95 -45.69 109.81 0.21 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.194 -0.457 . . . . 73.31 110.953 179.892 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 15.0 t -95.06 -6.65 41.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.261 -0.427 . . . . 71.34 111.17 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.1 m -65.67 177.94 1.13 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.257 -0.429 . . . . 73.12 110.856 -179.786 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 8.8 mmtp -96.26 -12.0 25.17 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.129 -0.487 . . . . 71.12 110.872 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -156.79 142.64 9.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.261 -0.427 . . . . 74.14 111.093 179.924 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 89.9 t -115.69 130.37 70.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.187 -0.461 . . . . 72.25 111.131 179.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.7 146.83 41.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.193 -0.458 . . . . 75.51 111.212 179.962 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 4.9 p90 -141.54 146.79 36.78 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.289 -0.414 . . . . 70.51 110.974 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 6.2 ttt180 -150.69 139.0 20.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.155 -0.475 . . . . 74.3 110.862 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 14.2 mm -75.13 125.35 34.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.212 -0.449 . . . . 72.4 111.116 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.442 ' HB ' ' HA3' ' A' ' 137' ' ' GLY . 5.7 t -83.0 -40.58 16.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.139 -0.482 . . . . 74.41 111.175 179.881 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -151.0 169.41 21.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.141 -0.482 . . . . 64.24 110.845 -179.882 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 11.1 p90 -129.72 153.2 48.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.125 -0.489 . . . . 74.1 110.902 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.9 t -101.55 141.68 34.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.121 -0.49 . . . . 75.33 111.122 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.66 -17.78 1.47 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.173 -0.467 . . . . 72.14 110.894 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -65.09 -35.47 81.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.185 -0.462 . . . . 74.13 110.813 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.8 mp -144.71 152.21 51.93 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 121.616 0.722 . . . . 72.52 110.907 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . 0.432 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.3 Cg_endo -69.78 151.11 68.88 Favored 'Trans proline' 0 C--O 1.231 0.143 0 C-N-CA 122.762 2.308 . . . . 73.11 112.321 179.845 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 3.3 t-160 -52.68 -26.71 14.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.222 -0.444 . . . . 74.11 110.815 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.432 HG22 ' HB2' ' A' ' 101' ' ' PRO . 2.5 tp -76.64 -39.53 32.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.276 -0.42 . . . . 74.02 111.106 -179.939 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 3.3 m -69.24 -39.9 78.2 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.152 -0.476 . . . . 54.24 111.215 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 70.6 t -72.62 -45.87 56.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.165 -0.47 . . . . 73.13 111.098 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.589 ' O ' HG22 ' A' ' 109' ' ' VAL . 59.7 t0 -58.56 -44.98 89.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.453 . . . . 63.44 110.844 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 14.4 ptm180 -70.2 -34.02 72.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.217 -0.447 . . . . 75.02 110.862 -179.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.55 ' HB3' ' HD2' ' A' ' 188' ' ' PHE . 0.0 OUTLIER -61.21 -49.56 76.65 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.133 -0.485 . . . . 75.05 110.901 -179.93 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.589 HG22 ' O ' ' A' ' 106' ' ' ASP . 1.4 m -55.99 -41.99 70.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.144 -0.48 . . . . 72.31 111.142 179.841 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.468 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 37.5 t -70.12 -34.16 72.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.19 -0.459 . . . . 72.14 110.869 -179.865 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.29 -32.86 73.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.12 -0.491 . . . . 74.35 110.923 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -95.63 -40.98 9.14 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.232 -0.44 . . . . 74.32 111.06 179.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.86 -33.15 75.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.278 -0.419 . . . . 74.11 110.856 -179.922 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 39.8 t30 -69.61 -39.14 77.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 75.15 110.844 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' MET . . . . . 0.411 ' O ' HD13 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -62.58 -34.78 77.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.165 -0.471 . . . . 74.0 110.964 179.868 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 7.0 m95 -62.41 -51.85 65.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.152 -0.476 . . . . 75.23 110.946 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' GLY . . . . . 0.557 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -73.42 -24.06 75.87 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.726 -0.75 . . . . 73.44 112.478 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 24.9 mtmt -67.75 -13.93 62.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.726 0.298 . . . . 74.42 110.883 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . 0.438 ' HG2' HD11 ' A' ' 226' ' ' LEU . 0.4 OUTLIER -107.51 13.93 26.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.278 -0.419 . . . . 75.55 110.824 -179.996 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . 0.557 ' CG1' ' HA2' ' A' ' 117' ' ' GLY . 7.5 pt -144.61 155.96 56.57 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.642 0.734 . . . . 71.34 111.141 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.79 4.68 2.06 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.681 2.254 . . . . 75.35 112.344 179.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.428 ' HB3' ' H ' ' A' ' 123' ' ' HIS . 4.9 mt -61.99 -156.36 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 73.22 110.88 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . 0.428 ' H ' ' HB3' ' A' ' 122' ' ' LEU . 4.9 t60 -163.12 138.06 6.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.227 -0.442 . . . . 74.12 110.868 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -123.35 141.77 51.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.165 -0.471 . . . . 75.54 110.864 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -121.55 141.54 50.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.141 -0.481 . . . . 75.14 110.838 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.78 146.48 30.95 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.18 -0.464 . . . . 74.04 110.913 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 29.6 m -103.12 126.26 57.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.243 -0.435 . . . . 50.13 111.13 179.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -141.55 -16.8 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.193 -0.458 . . . . 74.43 111.111 179.925 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -147.21 109.1 4.41 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.199 -0.455 . . . . 73.32 110.949 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.69 -161.46 13.57 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.734 -0.746 . . . . 62.11 112.461 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.85 156.65 17.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.752 0.311 . . . . 71.11 111.176 -179.883 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -111.22 164.62 12.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.213 -0.449 . . . . 72.32 111.089 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.53 -57.75 5.32 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.235 -0.439 . . . . 75.41 110.878 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 20.8 mt -82.57 132.86 30.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.222 -0.444 . . . . 71.04 111.138 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' MET . . . . . 0.424 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 27.7 mmt -109.31 115.65 30.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.161 -0.472 . . . . 72.43 110.893 179.879 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -106.07 90.51 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.237 -0.438 . . . . 70.04 111.086 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . 0.442 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -129.84 167.96 21.43 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.735 -0.745 . . . . 63.34 112.45 179.905 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 138' ' ' PHE . . . . . 0.402 ' CD1' ' HG2' ' A' ' 174' ' ' GLU . 2.0 m-85 -105.39 149.62 25.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.869 0.366 . . . . 74.01 110.898 -179.843 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . 175.84 167.23 0.39 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.129 -0.487 . . . . 71.21 111.104 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 72.8 mtt180 -104.14 173.78 6.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.217 -0.447 . . . . 72.34 110.853 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -56.59 -15.79 13.53 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.736 -0.745 . . . . 74.24 112.532 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -99.86 14.57 29.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.722 0.296 . . . . 75.03 111.023 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 12.0 p80 -68.21 -33.45 74.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.246 -0.434 . . . . 73.45 110.875 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 147.13 47.01 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.808 -0.711 . . . . 60.43 112.475 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -158.49 149.86 20.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.829 0.347 . . . . 72.14 110.859 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 146' ' ' SER . . . . . 0.489 ' O ' ' CB ' ' A' ' 147' ' ' TYR . 37.6 m -63.66 98.39 0.18 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.166 -0.47 . . . . 64.54 110.847 -179.738 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 147' ' ' TYR . . . . . 0.489 ' CB ' ' O ' ' A' ' 146' ' ' SER . 0.2 OUTLIER 161.81 119.93 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.622 0.725 . . . . 73.4 110.939 -179.853 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.81 143.83 51.82 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.677 2.251 . . . . 74.53 112.324 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 149' ' ' PHE . . . . . 0.529 ' O ' ' CG ' ' A' ' 150' ' ' ASP . 0.2 OUTLIER -54.03 -22.73 11.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.133 -0.485 . . . . 70.0 110.845 -179.955 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . 0.529 ' CG ' ' O ' ' A' ' 149' ' ' PHE . 2.8 p30 50.12 18.55 0.4 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.227 -0.442 . . . . 72.24 110.818 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 41.17 -159.73 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.703 -0.761 . . . . 75.42 112.495 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 144.51 54.54 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.697 2.265 . . . . 75.11 112.382 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . 0.444 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 105.8 -134.33 12.05 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.699 -0.762 . . . . 70.32 112.535 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 154' ' ' ASN . . . . . 0.444 ' C ' ' O ' ' A' ' 153' ' ' GLY . 4.3 p30 -34.27 133.67 0.22 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.885 0.374 . . . . 74.45 110.888 -179.952 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 155' ' ' THR . . . . . 0.439 ' CB ' ' O ' ' A' ' 154' ' ' ASN . 1.3 m 80.25 105.35 0.07 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.186 -0.461 . . . . 63.14 111.147 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 156' ' ' LEU . . . . . 0.45 HD11 HG13 ' A' ' 186' ' ' ILE . 0.6 OUTLIER -91.7 -55.53 3.44 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.236 -0.438 . . . . 75.02 110.965 179.895 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . 0.569 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -158.45 148.4 19.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.186 -0.461 . . . . 73.44 111.161 179.771 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 24.2 p-80 -111.24 116.33 30.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.243 -0.435 . . . . 74.34 110.845 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -110.86 151.46 27.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.228 -0.442 . . . . 74.42 111.114 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -118.73 161.17 20.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.216 -0.447 . . . . 75.31 110.845 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -93.12 164.75 20.37 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.598 0.714 . . . . 71.14 111.061 179.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.86 84.43 0.67 Allowed 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.671 2.247 . . . . 74.44 112.323 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -115.21 117.1 3.9 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.718 -0.753 . . . . 72.32 112.507 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 2.5 m 72.68 -69.47 0.19 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.852 0.358 . . . . 73.1 111.162 -179.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . 179.08 -61.56 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.729 -0.748 . . . . 74.03 112.439 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 166' ' ' LEU . . . . . 0.528 ' CD2' ' C ' ' A' ' 166' ' ' LEU . 0.0 OUTLIER -53.91 -21.5 7.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.813 0.34 . . . . 75.02 110.898 -179.9 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . 0.433 ' H ' HD11 ' A' ' 166' ' ' LEU . . . -80.45 -171.5 43.68 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.736 -0.745 . . . . 43.43 112.473 179.908 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 72.88 21.11 80.01 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.723 -0.751 . . . . 74.31 112.523 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 76.8 m-20 -93.69 162.3 13.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.847 0.356 . . . . 63.41 110.889 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -113.34 131.35 55.99 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.145 -0.48 . . . . 74.21 111.064 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 25.3 m170 -124.88 137.16 54.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.245 -0.434 . . . . 72.53 110.857 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 35.7 m-85 -118.73 139.27 51.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.179 -0.464 . . . . 71.44 110.91 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 55.3 t0 -72.24 100.99 2.72 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.16 -0.473 . . . . 74.11 110.857 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 174' ' ' GLU . . . . . 0.402 ' HG2' ' CD1' ' A' ' 138' ' ' PHE . 0.6 OUTLIER -57.86 -16.08 10.58 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.217 -0.447 . . . . 74.45 110.919 -179.879 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -79.32 -16.25 56.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.119 -0.492 . . . . 73.32 110.938 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 36.4 mm-40 -83.24 -179.51 7.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.18 -0.463 . . . . 71.41 110.878 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 1.5 mtt85 -116.26 113.71 23.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.116 -0.493 . . . . 74.32 110.829 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 5.8 m95 -116.64 147.91 41.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.271 -0.422 . . . . 74.32 110.905 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 9.2 t -178.73 163.56 1.46 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.246 -0.433 . . . . 74.13 111.194 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -121.7 -71.27 0.74 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.201 -0.454 . . . . 61.52 110.864 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -61.0 -14.9 40.67 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.787 -0.72 . . . . 62.41 112.451 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 182' ' ' SER . . . . . 0.451 ' O ' ' C ' ' A' ' 183' ' ' SER . 0.2 OUTLIER -94.89 -24.33 17.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.926 0.394 . . . . 74.0 110.886 -179.717 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 183' ' ' SER . . . . . 0.451 ' C ' ' O ' ' A' ' 182' ' ' SER . 30.8 m 32.78 59.21 0.42 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.144 -0.48 . . . . 64.12 110.821 -179.869 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 1.3 tt -116.73 -33.58 4.77 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.146 -0.479 . . . . 74.43 110.897 179.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -117.94 -137.95 5.88 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.697 -0.763 . . . . 74.22 112.531 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 186' ' ' ILE . . . . . 0.45 HG13 HD11 ' A' ' 156' ' ' LEU . 9.4 mm -79.48 97.58 2.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.859 0.361 . . . . 73.22 111.128 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -48.41 119.92 3.33 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.139 -0.482 . . . . 71.31 110.871 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 188' ' ' PHE . . . . . 0.55 ' HD2' ' HB3' ' A' ' 108' ' ' LEU . 1.5 t80 -54.16 -36.0 62.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.179 -0.464 . . . . 75.45 110.837 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . 0.406 HD21 HD12 ' A' ' 108' ' ' LEU . 0.0 OUTLIER -67.55 -47.85 68.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.144 -0.48 . . . . 60.14 110.901 -179.928 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 54.6 t80 -69.5 -39.11 77.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.195 -0.457 . . . . 74.22 110.909 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -72.52 -34.59 67.71 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.129 -0.487 . . . . 61.32 111.165 179.791 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 192' ' ' ALA . . . . . 0.529 ' O ' ' HB2' ' A' ' 196' ' ' LEU . . . -56.17 -44.73 79.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.207 -0.451 . . . . 52.32 111.118 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -57.97 -41.32 82.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.193 -0.458 . . . . 72.43 111.184 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -73.02 -46.3 52.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.272 -0.422 . . . . 71.44 110.867 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -68.24 -47.71 67.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.187 -0.461 . . . . 71.01 111.141 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 196' ' ' LEU . . . . . 0.529 ' HB2' ' O ' ' A' ' 192' ' ' ALA . 4.4 mm? -64.67 -41.86 95.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.152 -0.476 . . . . 74.52 110.95 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -55.07 -30.93 55.57 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.749 -0.738 . . . . 62.43 112.532 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 198' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 -66.97 -33.48 75.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.684 0.278 . . . . 75.21 110.839 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 5.5 t -68.5 -20.4 64.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.231 -0.44 . . . . 73.13 110.9 -179.778 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 200' ' ' LEU . . . . . 0.404 ' HA ' ' CD1' ' A' ' 84' ' ' TRP . 0.3 OUTLIER -90.57 -2.6 57.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.065 -0.516 . . . . 75.12 110.866 -179.968 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 84.27 8.75 83.12 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.796 -0.716 . . . . 50.41 112.519 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 202' ' ' MET . . . . . . . . . . . . . 32.9 tpp -67.54 142.13 56.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.829 0.347 . . . . 71.04 110.877 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -104.7 159.16 16.06 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.715 -0.755 . . . . 64.44 112.487 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 13.7 m-70 -58.58 159.35 6.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.795 0.331 . . . . 74.32 110.855 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -121.09 150.05 41.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.251 -0.432 . . . . 72.42 110.817 -179.736 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 4.3 p -87.99 -4.2 58.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.157 -0.474 . . . . 72.22 110.846 -179.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.18 138.12 84.48 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.57 0.7 . . . . 65.11 110.879 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.84 -8.13 22.83 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.663 2.242 . . . . 74.53 112.319 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -126.56 29.36 5.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.221 -0.445 . . . . 63.52 110.941 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 210' ' ' ALA . . . . . 0.419 ' HA ' ' HB3' ' A' ' 227' ' ' SER . . . -87.36 145.53 26.28 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.156 -0.474 . . . . 64.4 111.109 179.908 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -68.1 -28.34 40.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.215 -0.448 . . . . 75.23 111.147 179.954 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 21.0 mmm -96.97 9.89 40.72 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.169 -0.468 . . . . 75.22 110.893 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 213' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -55.6 114.99 8.28 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-O 121.718 0.77 . . . . 73.43 110.949 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.72 -18.45 37.17 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.675 2.25 . . . . 63.01 112.316 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -84.34 51.54 2.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.225 -0.443 . . . . 74.24 111.128 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 6.8 t80 . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 116.279 -0.419 . . . . 74.42 110.894 -179.919 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.905 0.383 . . . . 71.11 110.858 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -143.54 161.63 37.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.168 -0.469 . . . . 65.02 110.828 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 226' ' ' LEU . . . . . 0.438 HD11 ' HG2' ' A' ' 119' ' ' GLU . 37.5 mt -66.52 148.26 52.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.193 -0.458 . . . . 62.53 110.895 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 227' ' ' SER . . . . . 0.419 ' HB3' ' HA ' ' A' ' 210' ' ' ALA . 0.0 OUTLIER -87.89 152.84 21.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.189 -0.459 . . . . 74.21 110.837 -179.94 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -65.58 -68.65 0.35 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.12 -0.491 . . . . 74.54 110.9 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 229' ' ' ASP . . . . . 0.401 ' O ' ' HG2' ' A' ' 232' ' ' LYS . 0.4 OUTLIER -56.3 -24.7 45.1 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.223 -0.444 . . . . 74.2 110.897 179.965 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 40.4 t0 -68.38 -49.84 57.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 74.23 110.868 180.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 231' ' ' ILE . . . . . 0.434 HG13 ' HG2' ' A' ' 119' ' ' GLU . 2.8 mm -69.82 -43.15 80.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.225 -0.443 . . . . 73.41 111.085 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 232' ' ' LYS . . . . . 0.401 ' HG2' ' O ' ' A' ' 229' ' ' ASP . 7.9 ptmt -57.58 -31.87 66.59 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.191 -0.459 . . . . 73.32 110.916 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -68.83 -45.54 64.09 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.714 -0.755 . . . . 65.45 112.486 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 5.5 tt -72.86 -34.36 46.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.724 0.297 . . . . 74.41 111.223 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -66.31 -26.89 67.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.116 -0.493 . . . . 71.13 110.956 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 236' ' ' LYS . . . . . 0.447 ' HE3' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.67 -22.48 58.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.169 -0.468 . . . . 74.41 110.927 179.925 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 237' ' ' LEU . . . . . 0.514 HD21 ' CG ' ' A' ' 83' ' ' LYS . 1.1 tp -97.24 -16.13 20.51 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.166 -0.47 . . . . 75.41 110.908 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 238' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -105.39 -35.19 7.59 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.189 -0.459 . . . . 54.42 110.946 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.309 0 C-N-CA 120.726 -0.75 . . . . 72.22 112.46 179.986 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 37.5 t-105 . . . . . 0 C--O 1.23 0.051 0 CA-C-O 120.684 0.278 . . . . 71.22 110.923 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -72.98 -35.37 66.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.238 -0.437 . . . . 72.51 110.906 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -63.41 -36.78 84.88 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.156 -0.475 . . . . 74.32 110.881 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.44 -34.87 77.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.223 -0.444 . . . . 74.22 111.14 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -66.07 -43.0 88.64 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.155 -0.475 . . . . 73.12 110.95 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -76.81 -34.1 57.94 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.152 -0.477 . . . . 72.4 110.884 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -70.7 -35.91 73.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.15 -0.477 . . . . 75.11 110.911 -179.864 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -68.31 -26.03 65.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.159 -0.473 . . . . 75.43 110.873 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.551 ' HA ' ' CE1' ' A' ' 23' ' ' TYR . 7.0 ptmt -68.87 -37.11 78.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.178 -0.464 . . . . 75.45 110.86 179.899 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.438 ' N ' ' HG2' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -79.4 -21.83 45.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.255 -0.43 . . . . 74.22 110.88 -179.996 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -55.41 -30.39 60.34 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.235 -0.439 . . . . 75.2 110.827 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.551 ' CE1' ' HA ' ' A' ' 20' ' ' LYS . 44.9 p90 . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.104 -0.498 . . . . 74.4 110.923 -179.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.543 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 35.1 tp . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.746 0.308 . . . . 74.54 110.891 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -56.76 -50.7 71.49 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.146 -0.479 . . . . 73.13 110.933 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.55 -36.59 83.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.202 -0.454 . . . . 71.12 111.089 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.43 -48.62 60.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.254 -0.43 . . . . 74.43 110.935 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' A' ' 35' ' ' LEU . 10.2 mt -54.42 -38.59 66.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.159 -0.473 . . . . 74.44 110.937 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.0 ttmm -58.75 -46.1 88.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.166 -0.47 . . . . 74.2 110.828 179.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -70.11 -33.35 71.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.221 -0.445 . . . . 75.11 110.842 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 4.2 ttt -68.27 -46.43 70.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.222 -0.445 . . . . 63.43 110.861 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -63.96 -41.77 97.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.254 -0.43 . . . . 75.32 110.911 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.4 mmtt -66.69 -25.44 66.54 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.147 -0.478 . . . . 75.11 110.837 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 38.2 t80 -69.66 -37.03 76.55 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.29 -0.414 . . . . 73.32 110.88 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 11.8 m-85 -81.27 -31.47 33.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.174 -0.466 . . . . 70.43 110.901 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 104.55 -10.1 49.34 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.776 -0.726 . . . . 64.42 112.469 180.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.411 HD12 HG13 ' A' ' 50' ' ' ILE . 0.5 OUTLIER -61.62 144.13 93.02 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.612 0.72 . . . . 74.31 110.922 -179.923 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.72 -54.66 0.21 Allowed 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.66 2.24 . . . . 74.5 112.307 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.411 HG13 HD12 ' A' ' 48' ' ' LEU . 0.8 OUTLIER -51.04 108.26 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.248 -0.433 . . . . 72.24 111.132 179.988 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 40.3 p -123.38 157.41 33.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.214 -0.448 . . . . 73.25 111.129 179.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 84.06 -10.85 59.49 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.742 -0.742 . . . . 64.24 112.491 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 1.2 mtt -135.16 156.81 48.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.895 0.379 . . . . 75.23 110.874 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.408 ' HA ' ' HB ' ' A' ' 58' ' ' VAL . 1.9 pp -156.99 129.15 7.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.2 -0.455 . . . . 74.32 110.917 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 173.87 -29.33 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.216 -0.447 . . . . 61.31 110.936 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 26.1 t -94.16 -89.15 0.23 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.116 -0.493 . . . . 75.25 110.859 -179.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 7.6 tpt180 -84.76 -35.99 22.05 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.118 -0.492 . . . . 74.13 110.919 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.446 ' O ' HG12 ' A' ' 61' ' ' ILE . 21.8 t -60.26 -41.73 88.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.132 -0.485 . . . . 72.2 111.132 179.941 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -74.67 -31.01 25.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.192 -0.458 . . . . 75.2 111.133 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -59.97 -43.79 94.88 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.128 -0.487 . . . . 73.45 110.921 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.446 HG12 ' O ' ' A' ' 58' ' ' VAL . 0.7 OUTLIER -65.92 -29.78 47.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.148 -0.478 . . . . 74.52 111.167 179.893 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 3.9 mmm -70.39 -33.75 71.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.133 -0.485 . . . . 74.01 110.889 179.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -88.08 -25.88 22.82 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.202 -0.454 . . . . 45.15 110.898 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.1 mtmp? -85.04 151.93 58.03 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.553 0.692 . . . . 75.32 110.927 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 143.68 51.57 Favored 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.695 2.264 . . . . 72.11 112.381 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 25.8 ttp180 -141.36 -85.52 0.18 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.273 -0.421 . . . . 73.22 110.855 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 16.2 p -145.67 143.75 29.99 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.233 -0.439 . . . . 72.31 110.894 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.573 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -89.08 11.87 68.01 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.683 -0.77 . . . . 64.23 112.466 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -116.93 141.4 28.25 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.577 0.703 . . . . 74.23 111.139 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.74 178.12 4.87 Favored 'Trans proline' 0 N--CA 1.465 -0.148 0 C-N-CA 122.719 2.28 . . . . 63.44 112.316 179.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -128.68 42.63 3.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.204 -0.453 . . . . 74.45 110.798 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.226 -0.443 . . . . 73.52 111.105 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo . . . . . 0 C--O 1.231 0.133 0 CA-C-O 120.841 0.267 . . . . 72.25 112.311 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 5.1 mtpt -106.78 155.24 19.91 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.231 -0.441 . . . . 72.53 110.934 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . 0.422 ' NE1' ' O ' ' A' ' 199' ' ' SER . 38.4 m0 -50.11 112.33 0.66 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.21 -0.45 . . . . 73.31 110.938 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -115.37 -8.1 12.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.251 -0.432 . . . . 71.34 111.105 -179.894 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -59.57 176.13 0.29 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.23 -0.441 . . . . 73.12 110.84 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.34 -30.78 25.21 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.075 -0.512 . . . . 71.12 110.832 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.4 ' HA ' ' O ' ' A' ' 123' ' ' HIS . 0.3 OUTLIER -156.79 144.48 10.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.269 -0.423 . . . . 74.14 111.113 179.865 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 21.7 t -129.33 134.53 63.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.14 -0.482 . . . . 72.25 111.116 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 22.0 p -115.66 151.84 34.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.213 -0.449 . . . . 75.51 111.137 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 4.6 p90 -132.2 146.01 51.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.227 -0.442 . . . . 70.51 110.937 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 9.4 ttt180 -146.61 136.5 23.33 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.088 -0.505 . . . . 74.3 110.828 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.4 mm -75.87 134.18 29.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.154 -0.475 . . . . 72.4 111.092 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.431 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 15.1 t -92.29 -40.37 12.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.174 -0.466 . . . . 74.41 111.196 179.776 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -150.41 169.45 21.41 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.16 -0.473 . . . . 64.24 110.848 -179.863 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 16.7 p90 -132.24 155.25 48.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.201 -0.454 . . . . 74.1 110.926 -179.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 2.9 t -99.72 141.89 31.93 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.076 -0.511 . . . . 75.33 111.126 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.4 -18.02 1.45 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.195 -0.457 . . . . 72.14 110.876 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -65.02 -35.95 82.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.183 -0.462 . . . . 74.13 110.839 -180.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.8 mp -144.24 152.45 54.2 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.554 0.693 . . . . 72.52 110.959 179.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.79 151.07 68.77 Favored 'Trans proline' 0 C--O 1.232 0.216 0 C-N-CA 122.717 2.278 . . . . 73.11 112.32 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 -51.07 -26.66 6.67 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.173 -0.467 . . . . 74.11 110.901 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 10.5 tp -76.74 -38.45 30.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.181 -0.463 . . . . 74.02 111.101 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 3.2 m -68.86 -39.47 79.85 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.197 -0.456 . . . . 54.24 111.198 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 69.9 t -73.0 -45.29 55.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.21 -0.45 . . . . 73.13 111.101 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.594 ' O ' HG21 ' A' ' 109' ' ' VAL . 43.3 t0 -60.39 -44.96 95.16 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.213 -0.449 . . . . 63.44 110.903 179.873 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 11.5 ptm180 -70.15 -33.5 71.88 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.183 -0.462 . . . . 75.02 110.925 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.543 ' HB3' ' HD2' ' A' ' 188' ' ' PHE . 0.0 OUTLIER -60.68 -48.89 79.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.193 -0.458 . . . . 75.05 110.922 -179.984 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.594 HG21 ' O ' ' A' ' 106' ' ' ASP . 1.5 m -55.44 -41.68 63.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.156 -0.475 . . . . 72.31 111.197 179.845 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.465 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 47.7 t -70.11 -33.57 72.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.173 -0.467 . . . . 72.14 110.875 -179.902 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -61.96 -33.01 73.5 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.091 -0.504 . . . . 74.35 110.892 179.929 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.29 -40.32 9.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.26 -0.427 . . . . 74.32 111.049 179.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 6.4 tp -65.31 -32.54 74.25 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.29 -0.413 . . . . 74.11 110.884 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -65.37 -38.4 89.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.213 -0.449 . . . . 75.15 110.87 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.24 -34.48 76.58 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.232 -0.44 . . . . 74.0 110.883 179.856 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 7.1 m95 -67.04 -52.41 42.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.223 -0.444 . . . . 75.23 110.863 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -59.65 -37.87 92.93 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.718 -0.753 . . . . 73.44 112.522 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.1 mmpt? -61.34 -17.07 52.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.729 0.3 . . . . 74.42 110.872 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . 0.426 ' HG2' HG13 ' A' ' 231' ' ' ILE . 0.5 OUTLIER -98.99 12.85 34.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.242 -0.436 . . . . 75.55 110.902 179.992 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 1.9 pt -148.28 145.76 21.35 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.711 0.767 . . . . 71.34 111.059 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.84 6.32 1.38 Allowed 'Trans proline' 0 C--N 1.343 0.249 0 C-N-CA 122.678 2.252 . . . . 75.35 112.341 179.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.1 mt -62.77 -156.95 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.203 -0.453 . . . . 73.22 110.962 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . 0.4 ' O ' ' HA ' ' A' ' 88' ' ' VAL . 4.3 t60 -154.6 123.15 6.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.284 -0.416 . . . . 74.12 110.882 179.882 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 9.2 m-30 -108.23 133.14 52.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.224 -0.444 . . . . 75.54 110.868 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.29 141.66 48.78 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.165 -0.47 . . . . 75.14 110.921 -179.915 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.82 160.27 24.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.197 -0.456 . . . . 74.04 110.852 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 18.2 m -103.1 126.61 57.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.185 -0.462 . . . . 50.13 111.102 179.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -146.96 -13.35 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.157 -0.474 . . . . 74.43 111.138 179.896 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -153.65 109.05 3.2 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.173 -0.467 . . . . 73.32 110.89 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 102.45 -165.09 16.66 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.804 -0.712 . . . . 62.11 112.541 179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.99 155.67 18.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.824 0.345 . . . . 71.11 111.093 -179.835 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -112.37 165.7 11.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.213 -0.449 . . . . 72.32 111.06 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -76.34 -41.67 47.53 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.19 -0.459 . . . . 75.41 110.885 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 3.9 mm -94.76 107.83 19.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.185 -0.461 . . . . 71.04 111.146 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' MET . . . . . 0.431 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 9.3 mmm -98.59 122.5 41.87 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.152 -0.476 . . . . 72.43 110.929 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -106.28 95.23 3.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.262 -0.426 . . . . 70.04 111.162 179.99 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . 0.423 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -132.6 165.93 23.63 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.755 -0.736 . . . . 63.34 112.495 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -107.11 147.07 30.49 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.838 0.351 . . . . 74.01 110.872 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . 170.96 166.35 0.08 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.166 -0.47 . . . . 71.21 111.131 179.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 34.8 mtp180 -105.05 173.57 6.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.183 -0.462 . . . . 72.34 110.87 -179.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -53.51 -22.02 15.36 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.742 -0.742 . . . . 74.24 112.455 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -67.48 -10.9 55.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.827 0.346 . . . . 75.03 111.163 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 2.5 p80 -68.81 -11.91 60.94 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 73.45 110.865 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 118.63 39.57 0.71 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.736 -0.745 . . . . 60.43 112.454 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -123.3 141.1 52.33 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.748 0.309 . . . . 72.14 110.872 -179.952 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 3.0 m -64.23 156.03 30.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.219 -0.446 . . . . 64.54 110.902 -179.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 64.93 133.24 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.691 0.758 . . . . 73.4 110.881 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 134.67 28.52 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.712 2.275 . . . . 74.53 112.358 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -66.99 -29.69 69.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.26 -0.427 . . . . 70.0 110.865 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 75.21 -2.8 2.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.118 -0.492 . . . . 72.24 110.94 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 57.0 -117.3 9.31 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.718 -0.753 . . . . 75.42 112.475 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 138.9 38.82 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.649 2.233 . . . . 75.11 112.34 -179.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 103.16 -147.9 17.02 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.779 -0.724 . . . . 70.32 112.501 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -39.97 149.04 0.07 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.887 0.375 . . . . 74.45 110.9 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER 75.99 110.55 0.07 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.158 -0.474 . . . . 63.14 111.131 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 156' ' ' LEU . . . . . 0.442 HD11 HG13 ' A' ' 186' ' ' ILE . 0.6 OUTLIER -96.1 -53.35 3.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.133 -0.485 . . . . 75.02 110.882 179.995 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . 0.573 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -161.63 147.71 13.91 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.209 -0.451 . . . . 73.44 111.069 179.8 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 24.5 p-80 -109.63 125.72 52.88 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 74.34 110.86 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -109.41 171.25 7.55 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.193 -0.458 . . . . 74.42 111.105 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -125.9 153.28 44.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 75.31 110.856 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -86.27 165.46 33.54 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.605 0.717 . . . . 71.14 111.061 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 162' ' ' PRO . . . . . 0.467 ' HD3' ' O ' ' A' ' 199' ' ' SER . 53.7 Cg_endo -69.73 75.52 1.19 Allowed 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.696 2.264 . . . . 74.44 112.36 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -136.29 102.61 0.41 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.708 -0.758 . . . . 72.32 112.481 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 68.28 174.5 0.28 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.775 0.321 . . . . 73.1 111.135 -179.908 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -52.07 -50.65 44.55 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.739 -0.743 . . . . 74.03 112.502 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -58.71 -31.19 68.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.845 0.355 . . . . 75.02 110.915 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -72.97 151.22 45.42 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.669 -0.777 . . . . 43.43 112.481 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 86.2 15.99 63.57 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.782 -0.723 . . . . 74.31 112.472 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -87.37 147.88 25.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.791 0.329 . . . . 63.41 110.898 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.58 130.38 56.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 74.21 111.088 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 50.0 m170 -131.43 139.04 49.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.244 -0.435 . . . . 72.53 110.807 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 48.5 m-85 -122.34 140.07 53.08 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.184 -0.462 . . . . 71.44 110.858 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 63.5 t0 -69.14 98.25 0.99 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.196 -0.456 . . . . 74.11 110.853 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.94 -16.46 12.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.157 -0.474 . . . . 74.45 110.857 -179.886 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -79.25 -16.25 56.76 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.112 -0.494 . . . . 73.32 110.85 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 27.8 mm-40 -81.99 -176.78 6.31 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.166 -0.47 . . . . 71.41 110.918 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 32.3 mtm180 -116.49 114.4 24.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 74.32 110.917 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 5.7 m95 -117.24 150.33 38.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.244 -0.434 . . . . 74.32 110.855 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 12.2 t -179.82 163.87 1.16 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.231 -0.441 . . . . 74.13 111.14 -179.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -122.27 -67.53 0.95 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.253 -0.43 . . . . 61.52 110.839 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -67.49 -10.73 58.29 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.748 -0.739 . . . . 62.41 112.495 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 182' ' ' SER . . . . . 0.458 ' O ' ' C ' ' A' ' 183' ' ' SER . 0.2 OUTLIER -98.28 -24.51 15.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.856 0.36 . . . . 74.0 110.888 -179.768 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 183' ' ' SER . . . . . 0.458 ' C ' ' O ' ' A' ' 182' ' ' SER . 53.0 p 32.69 61.58 0.36 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.085 -0.507 . . . . 64.12 110.877 -179.83 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 6.0 tt -116.89 -33.7 4.68 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 74.43 110.894 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -121.33 -136.45 5.04 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.734 -0.746 . . . . 74.22 112.503 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 186' ' ' ILE . . . . . 0.442 HG13 HD11 ' A' ' 156' ' ' LEU . 7.7 mm -79.36 97.41 2.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.871 0.367 . . . . 73.22 111.165 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -50.94 121.32 5.84 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.154 -0.476 . . . . 71.31 110.879 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 188' ' ' PHE . . . . . 0.543 ' HD2' ' HB3' ' A' ' 108' ' ' LEU . 1.5 t80 -54.2 -35.68 62.64 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.224 -0.444 . . . . 75.45 110.913 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.37 -48.17 68.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.094 -0.503 . . . . 60.14 110.865 -179.998 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 9.7 t80 -69.88 -37.45 76.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.152 -0.476 . . . . 74.22 110.935 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -72.55 -35.9 68.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.099 -0.501 . . . . 61.32 111.092 179.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 192' ' ' ALA . . . . . 0.518 ' O ' ' HB2' ' A' ' 196' ' ' LEU . . . -57.13 -45.19 83.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.251 -0.431 . . . . 52.32 111.105 179.952 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.78 -41.03 85.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.189 -0.46 . . . . 72.43 111.162 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 13.9 t-160 -73.1 -44.97 59.66 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.215 -0.448 . . . . 71.44 110.872 179.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -69.48 -48.15 61.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.244 -0.435 . . . . 71.01 111.101 179.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 196' ' ' LEU . . . . . 0.518 ' HB2' ' O ' ' A' ' 192' ' ' ALA . 4.4 mm? -64.06 -39.42 94.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.114 -0.493 . . . . 74.52 110.909 -179.908 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -63.31 -25.15 68.13 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.745 -0.741 . . . . 62.43 112.526 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 198' ' ' HIS . . . . . . . . . . . . . 5.5 m-70 -68.7 -43.6 75.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.834 0.35 . . . . 75.21 110.857 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 199' ' ' SER . . . . . 0.467 ' O ' ' HD3' ' A' ' 162' ' ' PRO . 0.2 OUTLIER -58.83 -25.68 63.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.233 -0.439 . . . . 73.13 110.921 -179.788 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 200' ' ' LEU . . . . . 0.42 HD22 ' CE2' ' A' ' 84' ' ' TRP . 0.6 OUTLIER -85.05 1.13 49.11 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.104 -0.498 . . . . 75.12 110.891 -179.989 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 85.19 -9.36 67.02 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.787 -0.72 . . . . 50.41 112.525 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 202' ' ' MET . . . . . 0.441 ' CE ' ' HB ' ' A' ' 234' ' ' ILE . 0.0 OUTLIER -54.2 134.52 44.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.808 0.337 . . . . 71.04 110.828 -179.964 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -101.05 172.69 23.66 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.719 -0.753 . . . . 64.44 112.465 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 204' ' ' HIS . . . . . 0.416 ' HA ' ' HB3' ' A' ' 212' ' ' MET . 20.7 m-70 -67.45 163.64 20.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.827 0.346 . . . . 74.32 110.864 -179.96 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -124.66 153.47 42.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.223 -0.444 . . . . 72.42 110.856 -179.781 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 3.1 p -87.64 -4.27 58.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.156 -0.475 . . . . 72.22 110.819 -179.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.19 135.88 84.62 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.58 0.705 . . . . 65.11 110.924 179.952 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -69.83 -6.15 17.95 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.594 2.196 . . . . 74.53 112.292 -179.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -130.05 29.96 4.87 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.227 -0.442 . . . . 63.52 110.9 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 210' ' ' ALA . . . . . 0.47 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.27 145.33 26.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.142 -0.481 . . . . 64.4 111.09 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -67.21 -27.67 39.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.153 -0.476 . . . . 75.23 111.199 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 212' ' ' MET . . . . . 0.416 ' HB3' ' HA ' ' A' ' 204' ' ' HIS . 1.3 ttm -97.11 8.61 44.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.13 -0.486 . . . . 75.22 110.861 179.918 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 213' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -55.78 116.55 12.44 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.697 0.761 . . . . 73.43 110.845 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.89 -18.41 36.43 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.711 2.274 . . . . 63.01 112.282 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.7 51.1 2.05 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.239 -0.437 . . . . 74.24 111.139 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 8.4 t80 . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.265 -0.425 . . . . 74.42 110.974 -179.93 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 224' ' ' PHE . . . . . 0.439 ' CD1' ' C ' ' A' ' 224' ' ' PHE . 0.3 OUTLIER . . . . . 0 CA--C 1.527 0.073 0 CA-C-O 120.92 0.391 . . . . 71.11 110.862 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 3.0 mttp -144.51 168.99 18.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.093 -0.503 . . . . 65.02 110.866 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 226' ' ' LEU . . . . . 0.408 HD11 ' HG2' ' A' ' 119' ' ' GLU . 21.9 mt -60.08 148.82 34.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 62.53 110.845 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 227' ' ' SER . . . . . 0.503 ' O ' HG12 ' A' ' 231' ' ' ILE . 0.0 OUTLIER -86.93 150.78 23.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.147 -0.479 . . . . 74.21 110.853 -179.95 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -64.38 -64.21 0.94 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.113 -0.494 . . . . 74.54 110.859 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -55.48 -26.92 45.21 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.174 -0.466 . . . . 74.2 110.864 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 61.7 t0 -69.73 -50.23 45.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.155 -0.475 . . . . 74.23 110.896 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 231' ' ' ILE . . . . . 0.503 HG12 ' O ' ' A' ' 227' ' ' SER . 3.9 mm -69.75 -40.59 79.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.183 -0.462 . . . . 73.41 111.154 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 232' ' ' LYS . . . . . 0.427 ' HG3' ' N ' ' A' ' 233' ' ' GLY . 0.0 OUTLIER -56.46 -31.93 64.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.222 -0.445 . . . . 73.32 110.918 179.835 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 233' ' ' GLY . . . . . 0.427 ' N ' ' HG3' ' A' ' 232' ' ' LYS . . . -64.82 -49.72 62.04 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.729 -0.748 . . . . 65.45 112.529 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 234' ' ' ILE . . . . . 0.441 ' HB ' ' CE ' ' A' ' 202' ' ' MET . 8.4 tt -72.99 -30.28 31.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 120.76 0.314 . . . . 74.41 111.104 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -61.46 -29.29 69.87 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.233 -0.439 . . . . 71.13 110.896 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 236' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.58 -25.46 59.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.267 -0.424 . . . . 74.41 110.887 -179.998 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 237' ' ' LEU . . . . . . . . . . . . . 9.7 tt -97.42 -26.22 14.93 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.259 -0.428 . . . . 75.41 110.899 179.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 238' ' ' TYR . . . . . 0.428 ' CD1' HG13 ' A' ' 234' ' ' ILE . 5.4 m-85 -92.44 -35.38 13.69 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.235 -0.439 . . . . 54.42 110.881 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.314 0 C-N-CA 120.735 -0.745 . . . . 72.22 112.482 179.958 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 6.5 t-105 . . . . . 0 C--O 1.232 0.15 0 CA-C-O 120.668 0.271 . . . . 71.22 110.847 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -63.96 -36.67 84.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.341 -0.39 . . . . 72.51 110.902 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -63.07 -36.89 85.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 74.32 110.897 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.16 -37.36 71.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.166 -0.47 . . . . 74.22 111.099 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -67.16 -43.0 83.38 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.2 -0.455 . . . . 73.12 110.917 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -70.08 -31.41 68.99 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.162 -0.472 . . . . 72.4 110.882 180.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 14.8 m-85 -67.68 -50.5 57.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.188 -0.46 . . . . 75.11 110.948 -179.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.417 ' HA ' ' HB2' ' A' ' 22' ' ' PHE . 2.8 tm? -67.82 -33.46 74.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.094 -0.503 . . . . 75.43 110.836 -179.94 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 4.9 tptt -57.15 -39.82 76.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.196 -0.456 . . . . 75.45 110.902 179.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.8 ptm180 -83.91 -25.29 30.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.242 -0.435 . . . . 74.22 110.917 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.417 ' HB2' ' HA ' ' A' ' 19' ' ' LEU . 0.4 OUTLIER -59.08 -20.17 50.93 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 75.2 110.865 -179.936 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 3.8 p90 . . . . . 0 C--N 1.328 -0.357 0 CA-C-N 116.182 -0.463 . . . . 74.4 110.958 -179.868 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.419 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 1.3 tt . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.77 0.319 . . . . 74.54 110.861 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -57.24 -52.64 64.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.268 -0.424 . . . . 73.13 110.931 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.48 -36.76 84.83 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.153 -0.476 . . . . 71.12 111.1 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.455 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 2.7 mmtm -65.19 -49.13 70.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.189 -0.46 . . . . 74.43 110.861 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 35' ' ' LEU . 4.6 mt -62.64 -35.54 79.93 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.209 -0.45 . . . . 74.44 110.874 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 26.0 tttt -60.1 -45.6 92.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.191 -0.459 . . . . 74.2 110.888 179.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 1.7 pt-20 -60.56 -32.73 71.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.192 -0.458 . . . . 75.11 110.877 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 13.9 ttt -65.68 -34.05 77.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.145 -0.48 . . . . 63.43 110.887 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.413 ' HG3' ' HA ' ' A' ' 51' ' ' THR . 2.7 mm-40 -64.11 -39.65 94.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.239 -0.437 . . . . 75.32 110.847 -179.929 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.2 mmpt? -68.52 -29.21 67.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.192 -0.458 . . . . 75.11 110.915 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -70.05 -42.31 73.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 73.32 110.923 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 10.4 m-85 -82.1 -35.33 28.7 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.206 -0.452 . . . . 70.43 110.803 -179.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 104.74 -10.15 48.68 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.718 -0.753 . . . . 64.42 112.414 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.66 138.57 93.05 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.607 0.718 . . . . 74.31 110.941 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.73 -53.25 0.28 Allowed 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.643 2.229 . . . . 74.5 112.386 179.844 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -52.39 108.23 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.242 -0.435 . . . . 72.24 111.137 179.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.413 ' HA ' ' HG3' ' A' ' 43' ' ' GLN . 68.2 p -116.22 168.53 10.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.214 -0.448 . . . . 73.25 111.174 179.917 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 65.19 12.51 55.52 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.763 -0.732 . . . . 64.24 112.495 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.2 ppp? -124.72 161.12 27.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.836 0.35 . . . . 75.23 110.868 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 18.4 tp -162.53 94.03 0.86 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.213 -0.449 . . . . 74.32 110.933 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 172.9 -26.13 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.122 -0.49 . . . . 61.31 110.927 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 44.3 m -89.34 -100.5 0.09 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.171 -0.468 . . . . 75.25 110.851 -179.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 12.9 tpt180 -84.62 -28.23 26.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.126 -0.488 . . . . 74.13 110.874 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 97.3 t -62.68 -41.33 91.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.218 -0.446 . . . . 72.2 111.112 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 1.8 mm -74.97 -31.58 25.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.177 -0.465 . . . . 75.2 111.167 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -60.06 -44.12 94.95 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 73.45 110.86 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 24.4 pt -70.34 -30.01 41.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.175 -0.466 . . . . 74.52 111.147 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 2.1 mmm -67.77 -35.26 78.38 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.144 -0.48 . . . . 74.01 110.832 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -87.67 -24.06 24.02 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.209 -0.451 . . . . 45.15 110.861 -179.874 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 50.5 mtmt -85.02 113.88 52.61 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.596 0.712 . . . . 75.32 110.864 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.78 148.05 64.07 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.71 2.273 . . . . 72.11 112.361 179.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 1.5 ppt_? -154.7 -59.48 0.11 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.252 -0.431 . . . . 73.22 110.829 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -146.14 144.88 30.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.215 -0.448 . . . . 72.31 110.884 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.554 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -101.75 15.37 57.09 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.781 -0.723 . . . . 64.23 112.491 -179.922 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -101.86 137.0 19.41 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.642 0.734 . . . . 74.23 111.111 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.82 165.41 31.12 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.632 2.221 . . . . 63.44 112.387 179.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -135.01 46.27 2.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.253 -0.43 . . . . 74.45 110.867 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.263 -0.426 . . . . 73.52 111.066 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo . . . . . 0 C--O 1.231 0.172 0 CA-C-O 120.798 0.249 . . . . 72.25 112.308 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.418 ' HD2' ' CD2' ' A' ' 237' ' ' LEU . 5.4 mttp -63.34 151.02 41.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.269 -0.423 . . . . 72.53 110.898 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . 0.5 ' CD1' ' HG3' ' A' ' 162' ' ' PRO . 39.7 m0 -50.97 109.49 0.33 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.198 -0.455 . . . . 73.31 110.961 179.902 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -105.02 -14.7 15.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.25 -0.432 . . . . 71.34 111.183 -179.957 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -58.16 153.5 14.82 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.188 -0.46 . . . . 73.12 110.897 -179.879 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 14.6 mmtp -65.91 -30.62 71.24 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.178 -0.465 . . . . 71.12 110.91 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -154.79 142.25 12.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.208 -0.451 . . . . 74.14 111.132 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 54.8 t -123.61 139.21 50.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.183 -0.462 . . . . 72.25 111.082 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 31.6 p -115.96 147.12 41.5 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.113 -0.494 . . . . 75.51 111.099 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 17.5 p90 -131.36 146.6 52.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.21 -0.45 . . . . 70.51 110.971 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 9.1 ttt180 -147.71 138.47 23.31 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.082 -0.508 . . . . 74.3 110.897 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 9.8 mm -75.21 135.09 27.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.223 -0.444 . . . . 72.4 111.156 179.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.456 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 21.1 t -91.47 -40.27 12.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.187 -0.461 . . . . 74.41 111.142 179.829 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 35.1 t -151.05 169.36 22.02 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.196 -0.456 . . . . 64.24 110.807 -179.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 13.2 p90 -131.86 155.09 48.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.078 -0.51 . . . . 74.1 110.95 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.7 t -103.32 141.71 35.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.129 -0.487 . . . . 75.33 111.14 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 2.1 mmt180 -52.53 -18.45 1.72 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.214 -0.448 . . . . 72.14 110.842 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.03 -37.42 87.54 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.199 -0.455 . . . . 74.13 110.86 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -142.09 152.4 61.45 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.594 0.711 . . . . 72.52 110.895 -179.957 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . 0.4 ' HB2' HG21 ' A' ' 103' ' ' ILE . 54.4 Cg_endo -69.71 151.21 69.3 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.724 2.283 . . . . 73.11 112.311 179.832 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -52.96 -26.29 14.68 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.196 -0.457 . . . . 74.11 110.814 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.4 HG21 ' HB2' ' A' ' 101' ' ' PRO . 5.5 tt -77.1 -39.51 29.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.312 -0.403 . . . . 74.02 111.124 179.9 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' THR . . . . . 0.4 ' CB ' ' HG2' ' A' ' 101' ' ' PRO . 3.4 m -69.12 -36.79 77.87 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.241 -0.436 . . . . 54.24 111.177 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 57.5 t -71.27 -42.15 74.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.172 -0.467 . . . . 73.13 111.165 179.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.59 ' O ' HG22 ' A' ' 109' ' ' VAL . 22.9 t0 -68.66 -38.21 80.25 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.217 -0.447 . . . . 63.44 110.928 179.888 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . 0.497 ' HG3' ' N ' ' A' ' 108' ' ' LEU . 0.0 OUTLIER -70.0 -33.49 72.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.153 -0.476 . . . . 75.02 110.869 -179.869 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.499 ' HB3' ' HD1' ' A' ' 188' ' ' PHE . 0.0 OUTLIER -64.64 -47.76 77.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.188 -0.46 . . . . 75.05 110.993 179.929 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.59 HG22 ' O ' ' A' ' 106' ' ' ASP . 1.3 m -55.16 -41.32 59.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 72.31 111.201 179.797 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.464 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 44.8 t -70.0 -34.67 73.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.174 -0.466 . . . . 72.14 110.892 -179.906 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -63.46 -34.64 78.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.11 -0.496 . . . . 74.35 110.887 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -92.27 -40.42 10.96 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.233 -0.44 . . . . 74.32 111.069 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 9.2 tp -64.4 -32.59 74.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.224 -0.444 . . . . 74.11 110.977 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 39.7 t30 -66.66 -38.77 87.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.209 -0.45 . . . . 75.15 110.886 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.84 -34.7 74.97 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.167 -0.469 . . . . 74.0 110.906 179.906 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' TRP . . . . . 0.415 ' O ' HG12 ' A' ' 120' ' ' ILE . 8.7 m95 -68.52 -38.81 81.22 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.186 -0.461 . . . . 75.23 110.872 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' GLY . . . . . 0.451 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -73.64 -33.91 57.48 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.76 -0.733 . . . . 73.44 112.456 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.7 -15.04 57.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.722 0.296 . . . . 74.42 110.863 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -106.25 13.56 28.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.264 -0.426 . . . . 75.55 110.954 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . 0.529 ' C ' ' H ' ' A' ' 122' ' ' LEU . 7.3 pt -149.79 142.48 15.83 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.635 0.731 . . . . 71.34 111.157 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -69.86 25.32 0.18 Allowed 'Trans proline' 0 C--O 1.232 0.201 0 C-N-CA 122.641 2.228 . . . . 75.35 112.321 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.529 ' H ' ' C ' ' A' ' 120' ' ' ILE . 14.3 mt -81.49 -159.42 0.27 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.206 -0.452 . . . . 73.22 110.934 179.97 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 4.1 t60 -157.25 137.26 12.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.237 -0.438 . . . . 74.12 110.929 179.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . 0.401 ' CE2' ' HA3' ' A' ' 117' ' ' GLY . 20.9 m-85 -117.68 138.23 52.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.197 -0.456 . . . . 75.54 110.931 -179.897 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -118.27 141.48 48.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.149 -0.478 . . . . 75.14 110.821 -179.815 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.55 154.63 27.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.171 -0.468 . . . . 74.04 110.915 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 19.5 m -103.38 126.91 57.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.189 -0.46 . . . . 50.13 111.132 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -145.13 -25.99 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.208 -0.451 . . . . 74.43 111.152 179.901 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -139.76 109.27 6.22 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.176 -0.465 . . . . 73.32 110.877 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 103.0 -167.48 17.17 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.682 -0.77 . . . . 62.11 112.469 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -101.76 156.15 17.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.741 0.305 . . . . 71.11 111.158 -179.842 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -111.72 165.29 12.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.246 -0.433 . . . . 72.32 111.135 179.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -74.45 -44.57 51.12 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.242 -0.436 . . . . 75.41 110.893 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 3.8 mm -89.39 113.3 25.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 71.04 111.172 179.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' MET . . . . . 0.456 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 8.4 mmm -101.82 122.59 44.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.177 -0.465 . . . . 72.43 110.877 179.864 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -107.0 93.42 2.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 70.04 111.123 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -130.17 173.1 20.03 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.709 -0.757 . . . . 63.34 112.418 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 51.4 m-85 -108.48 149.83 28.26 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.854 0.359 . . . . 74.01 110.904 -179.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . 170.35 166.12 0.07 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.165 -0.47 . . . . 71.21 111.118 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . 0.451 ' HB2' ' CB ' ' A' ' 149' ' ' PHE . 1.9 ptt180 -109.59 174.14 6.0 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.234 -0.439 . . . . 72.34 110.908 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -55.34 -18.93 15.53 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.676 -0.773 . . . . 74.24 112.53 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -91.43 13.18 18.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.793 0.33 . . . . 75.03 111.082 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 2.2 p80 -77.91 -15.75 58.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.212 -0.449 . . . . 73.45 110.855 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 128.27 49.62 0.15 Allowed Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.74 -0.743 . . . . 60.43 112.492 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -153.26 169.55 22.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.827 0.346 . . . . 72.14 110.863 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.38 165.47 11.81 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.216 -0.447 . . . . 64.54 110.902 -179.799 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 12.6 m-85 64.75 134.07 0.04 OUTLIER Pre-proline 0 C--N 1.327 -0.377 0 CA-C-O 121.724 0.773 . . . . 73.4 110.919 -179.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 151.35 68.85 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.674 2.249 . . . . 74.53 112.337 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 149' ' ' PHE . . . . . 0.475 ' C ' ' H ' ' A' ' 151' ' ' GLY . 10.4 p90 -53.19 -44.63 68.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.265 -0.425 . . . . 70.0 110.861 -179.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 75.52 -21.23 0.31 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.088 -0.506 . . . . 72.24 110.882 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . 0.475 ' H ' ' C ' ' A' ' 149' ' ' PHE . . . 68.04 -139.83 35.06 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.726 -0.749 . . . . 75.42 112.434 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.69 142.43 48.2 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.647 2.231 . . . . 75.11 112.357 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . 0.449 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 104.38 -143.47 15.69 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.768 -0.73 . . . . 70.32 112.437 179.918 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 154' ' ' ASN . . . . . 0.449 ' C ' ' O ' ' A' ' 153' ' ' GLY . 4.1 p30 -34.52 141.23 0.06 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.922 0.392 . . . . 74.45 110.867 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 75.72 117.88 0.06 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.126 -0.488 . . . . 63.14 111.098 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 156' ' ' LEU . . . . . 0.471 HD12 HG13 ' A' ' 186' ' ' ILE . 1.2 tp -107.07 -51.8 2.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.464 . . . . 75.02 110.955 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . 0.554 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -154.67 149.58 26.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.209 -0.45 . . . . 73.44 111.025 179.787 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 29.3 p-80 -116.39 110.94 19.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.172 -0.467 . . . . 74.34 110.816 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -110.95 170.3 8.19 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.313 -0.403 . . . . 74.42 111.118 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -146.65 164.35 32.94 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.208 -0.451 . . . . 75.31 110.868 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -93.74 164.99 18.96 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.498 0.666 . . . . 71.14 111.16 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 162' ' ' PRO . . . . . 0.5 ' HG3' ' CD1' ' A' ' 84' ' ' TRP . 54.1 Cg_endo -69.76 77.23 1.08 Allowed 'Trans proline' 0 C--O 1.231 0.169 0 C-N-CA 122.726 2.284 . . . . 74.44 112.35 -179.942 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -112.41 120.42 5.29 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.741 -0.742 . . . . 72.32 112.457 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 1.2 m 76.17 -58.97 0.52 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.789 0.328 . . . . 73.1 111.148 -179.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . 172.1 -56.49 0.17 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.784 -0.722 . . . . 74.03 112.483 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 1.3 tt -60.81 -18.08 53.37 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.83 0.348 . . . . 75.02 110.925 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -71.03 176.91 36.25 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.757 -0.735 . . . . 43.43 112.494 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 76.47 13.63 83.22 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.711 -0.757 . . . . 74.31 112.536 -179.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -94.05 149.69 21.01 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.822 0.344 . . . . 63.41 110.887 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.33 130.9 55.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.249 -0.432 . . . . 74.21 111.148 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 62.9 m170 -128.05 132.75 49.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.218 -0.446 . . . . 72.53 110.906 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 172' ' ' PHE . . . . . 0.406 ' HA ' ' HB1' ' A' ' 157' ' ' ALA . 30.3 m-85 -112.04 139.2 47.75 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.216 -0.447 . . . . 71.44 110.919 -179.898 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -70.22 99.74 1.57 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.206 -0.452 . . . . 74.11 110.869 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.78 -16.67 12.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.231 -0.441 . . . . 74.45 110.893 -179.896 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 -76.25 -16.07 59.88 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.182 -0.463 . . . . 73.32 110.859 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -87.95 -176.22 5.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 71.41 110.88 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 48.0 mtm180 -110.83 119.74 40.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.158 -0.474 . . . . 74.32 110.93 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 48.9 m95 -117.04 139.16 51.03 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.256 -0.429 . . . . 74.32 110.934 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 7.1 t -177.33 163.51 2.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.267 -0.424 . . . . 74.13 111.151 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -125.65 -68.55 0.83 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.233 -0.44 . . . . 61.52 110.916 179.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -65.26 -11.16 51.34 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.745 -0.74 . . . . 62.41 112.416 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 182' ' ' SER . . . . . 0.438 ' O ' ' C ' ' A' ' 183' ' ' SER . 1.5 m -97.34 -24.42 15.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.833 0.349 . . . . 74.0 110.907 -179.831 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 183' ' ' SER . . . . . 0.438 ' C ' ' O ' ' A' ' 182' ' ' SER . 12.1 m 34.82 61.76 0.57 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.147 -0.479 . . . . 64.12 110.88 -179.824 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -116.9 -33.59 4.71 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.067 -0.515 . . . . 74.43 110.942 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -122.3 -136.38 4.9 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.671 -0.776 . . . . 74.22 112.442 179.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 186' ' ' ILE . . . . . 0.471 HG13 HD12 ' A' ' 156' ' ' LEU . 8.2 mm -79.41 99.53 3.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.814 0.34 . . . . 73.22 111.138 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -50.29 121.79 6.06 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.18 -0.464 . . . . 71.31 110.844 -179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 188' ' ' PHE . . . . . 0.499 ' HD1' ' HB3' ' A' ' 108' ' ' LEU . 1.7 t80 -53.85 -34.84 60.54 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.207 -0.451 . . . . 75.45 110.905 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.25 -47.46 70.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 60.14 110.905 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 13.1 m-30 -69.47 -41.44 76.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.226 -0.443 . . . . 74.22 110.893 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -68.38 -35.91 78.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.177 -0.465 . . . . 61.32 111.094 179.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 192' ' ' ALA . . . . . 0.471 ' O ' ' HB2' ' A' ' 196' ' ' LEU . . . -58.56 -44.61 89.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.199 -0.455 . . . . 52.32 111.125 179.919 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -58.24 -42.9 87.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.152 -0.476 . . . . 72.43 111.178 -179.904 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 8.0 t-160 -72.84 -41.64 64.59 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.215 -0.448 . . . . 71.44 110.876 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -71.44 -47.92 52.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 71.01 111.095 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 196' ' ' LEU . . . . . 0.476 HD22 ' N ' ' A' ' 196' ' ' LEU . 4.4 mm? -63.82 -44.34 93.54 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.312 -0.404 . . . . 74.52 110.955 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -58.85 -27.47 61.94 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.698 -0.763 . . . . 62.43 112.552 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 198' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 -67.38 -43.79 80.52 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.778 0.323 . . . . 75.21 110.909 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.15 -26.33 64.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.232 -0.44 . . . . 73.13 110.855 -179.794 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -83.98 2.96 36.38 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.138 -0.483 . . . . 75.12 110.926 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 83.52 -8.04 66.55 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.759 -0.734 . . . . 50.41 112.469 179.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 202' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -49.84 134.84 20.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.833 0.349 . . . . 71.04 110.85 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -102.66 159.1 17.72 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.727 -0.749 . . . . 64.44 112.468 -179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 29.2 m-70 -58.7 158.26 8.21 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.786 0.327 . . . . 74.32 110.899 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -124.09 138.97 54.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.253 -0.43 . . . . 72.42 110.939 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 3.1 p -76.79 -4.46 43.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.131 -0.486 . . . . 72.22 110.829 -179.742 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.71 135.09 83.58 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.624 0.726 . . . . 65.11 110.899 179.904 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.72 -6.3 18.26 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.709 2.273 . . . . 74.53 112.328 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -123.1 22.89 9.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.222 -0.444 . . . . 63.52 110.942 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 210' ' ' ALA . . . . . 0.479 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.13 145.63 26.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.15 -0.477 . . . . 64.4 111.144 179.851 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -69.56 -28.05 36.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.261 -0.427 . . . . 75.23 111.06 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 8.5 mmm -95.4 12.91 27.59 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.197 -0.456 . . . . 75.22 110.871 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 213' ' ' TYR . . . . . 0.418 ' CE2' ' HB ' ' A' ' 215' ' ' THR . 1.9 t80 -54.88 112.29 3.9 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-O 121.672 0.748 . . . . 73.43 110.898 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.82 -17.62 37.18 Favored 'Trans proline' 0 C--O 1.233 0.234 0 C-N-CA 122.698 2.266 . . . . 63.01 112.285 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 215' ' ' THR . . . . . 0.418 ' HB ' ' CE2' ' A' ' 213' ' ' TYR . 0.2 OUTLIER -83.48 59.53 5.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.29 -0.414 . . . . 74.24 111.127 -179.956 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.223 -0.444 . . . . 74.42 110.861 -179.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.526 0.055 0 CA-C-O 120.993 0.425 . . . . 71.11 110.823 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.92 163.43 32.82 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.08 -0.509 . . . . 65.02 110.851 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 11.5 mt -60.75 148.98 37.06 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.199 -0.455 . . . . 62.53 110.951 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 227' ' ' SER . . . . . 0.479 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 1.2 t -87.51 151.89 22.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.231 -0.441 . . . . 74.21 110.804 -179.882 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 19.7 tt0 -62.34 -66.07 0.59 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.146 -0.479 . . . . 74.54 110.809 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -55.55 -26.19 41.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.191 -0.459 . . . . 74.2 110.885 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -69.15 -48.12 63.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.179 -0.464 . . . . 74.23 110.867 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 231' ' ' ILE . . . . . . . . . . . . . 7.9 mt -68.3 -43.21 84.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.197 -0.456 . . . . 73.41 111.059 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 2.0 pttp -62.84 -31.85 72.95 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.232 -0.44 . . . . 73.32 110.915 179.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -62.62 -49.95 68.68 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.813 -0.708 . . . . 65.45 112.473 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 234' ' ' ILE . . . . . 0.423 ' CG1' ' CD1' ' A' ' 238' ' ' TYR . 6.7 tt -73.07 -30.83 32.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.865 0.364 . . . . 74.41 111.174 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -68.67 -24.03 64.47 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.123 -0.489 . . . . 71.13 110.977 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 236' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.76 -28.17 60.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.126 -0.488 . . . . 74.41 110.915 179.911 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 237' ' ' LEU . . . . . 0.418 ' CD2' ' HD2' ' A' ' 83' ' ' LYS . 10.3 tt -98.02 -29.36 13.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.149 -0.478 . . . . 75.41 110.889 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 238' ' ' TYR . . . . . 0.423 ' CD1' ' CG1' ' A' ' 234' ' ' ILE . 27.9 m-85 -91.99 -35.46 13.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.245 -0.434 . . . . 54.42 110.916 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.388 0 C-N-CA 120.784 -0.722 . . . . 72.22 112.479 179.962 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 19.4 t-105 . . . . . 0 C--O 1.23 0.071 0 CA-C-O 120.741 0.305 . . . . 71.22 110.886 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -72.26 -42.2 65.89 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.19 -0.459 . . . . 72.51 110.892 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -63.54 -36.85 85.15 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.156 -0.475 . . . . 74.32 110.944 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.19 -34.85 68.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.113 -0.494 . . . . 74.22 111.104 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -69.88 -37.83 76.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.242 -0.435 . . . . 73.12 110.987 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -77.47 -31.56 53.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.179 -0.464 . . . . 72.4 110.811 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 4.0 m-30 -59.79 -36.09 75.99 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.212 -0.449 . . . . 75.11 110.897 -179.794 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -72.11 -21.01 61.54 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.146 -0.479 . . . . 75.43 110.876 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.4 ptmt -77.62 -26.56 50.65 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.219 -0.446 . . . . 75.45 110.901 179.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.43 ' HG3' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -83.83 -27.85 28.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.444 . . . . 74.22 110.871 -179.989 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.43 ' N ' ' HG3' ' A' ' 21' ' ' ARG . 2.7 m-85 -60.79 -22.36 64.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.196 -0.456 . . . . 75.2 110.868 -179.898 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 . . . . . 0 C--N 1.328 -0.35 0 CA-C-N 116.206 -0.452 . . . . 74.4 110.899 -179.845 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.51 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 1.8 mm? . . . . . 0 C--O 1.23 0.062 0 CA-C-O 120.782 0.325 . . . . 74.54 110.922 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.64 -50.87 71.73 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.211 -0.449 . . . . 73.13 110.943 179.858 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.56 -36.76 84.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.122 -0.49 . . . . 71.12 111.103 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.49 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.7 OUTLIER -68.66 -49.75 56.62 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.181 -0.463 . . . . 74.43 110.865 -179.995 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 35' ' ' LEU . 7.0 mt -56.44 -36.89 69.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.28 -0.418 . . . . 74.44 110.919 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.9 mttt -58.52 -45.56 88.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.146 -0.479 . . . . 74.2 110.878 179.856 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.49 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 2.3 pt-20 -60.43 -32.58 71.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.254 -0.43 . . . . 75.11 110.919 179.931 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.3 tmt? -68.25 -34.36 76.05 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.12 -0.491 . . . . 63.43 110.914 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.452 ' HG2' ' O ' ' A' ' 39' ' ' LEU . 6.8 mm-40 -57.14 -39.64 75.6 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.265 -0.425 . . . . 75.32 110.952 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.4 mmpt? -69.9 -28.27 65.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.137 -0.483 . . . . 75.11 110.947 179.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 43.6 t80 -70.37 -37.56 74.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.175 -0.466 . . . . 73.32 110.895 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -81.84 -35.04 29.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.158 -0.474 . . . . 70.43 110.898 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 106.06 -10.27 43.84 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.804 -0.712 . . . . 64.42 112.478 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.68 139.11 96.91 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.603 0.716 . . . . 74.31 110.931 -179.937 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.72 -51.98 0.36 Allowed 'Trans proline' 0 C--O 1.232 0.22 0 C-N-CA 122.67 2.246 . . . . 74.5 112.329 179.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -53.01 108.15 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.223 -0.444 . . . . 72.24 111.133 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.426 ' HA ' ' HG3' ' A' ' 43' ' ' GLN . 3.7 t -119.75 155.96 31.47 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.178 -0.465 . . . . 73.25 111.109 179.984 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.54 -7.58 57.39 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.774 -0.727 . . . . 64.24 112.435 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 15.3 mtt -135.1 161.17 36.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.789 0.328 . . . . 75.23 110.853 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.407 ' HA ' ' HB ' ' A' ' 58' ' ' VAL . 2.8 pp -156.59 128.97 7.53 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.169 -0.469 . . . . 74.32 110.941 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 176.2 -30.31 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 61.31 110.852 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 20.4 p -93.51 -88.48 0.23 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.218 -0.446 . . . . 75.25 110.821 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 2.9 mmm180 -84.71 -35.55 22.44 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.131 -0.486 . . . . 74.13 110.832 -179.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.407 ' HB ' ' HA ' ' A' ' 54' ' ' LEU . 16.6 t -60.64 -43.71 95.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.169 -0.469 . . . . 72.2 111.122 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -74.82 -31.25 25.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.244 -0.434 . . . . 75.2 111.155 179.951 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -67.17 -44.13 80.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.132 -0.485 . . . . 73.45 110.982 179.87 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 37.3 pt -66.89 -30.06 48.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.184 -0.462 . . . . 74.52 111.107 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -58.47 -40.67 83.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.181 -0.463 . . . . 74.01 110.893 179.888 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 16.0 pt20 -91.66 -23.94 19.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.29 -0.414 . . . . 45.15 110.905 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 4.2 ttmm -78.8 114.43 43.79 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.549 0.69 . . . . 75.32 110.906 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.85 140.22 41.82 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.668 2.246 . . . . 72.11 112.268 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -140.78 -61.69 0.49 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.157 -0.474 . . . . 73.22 110.873 -179.961 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -145.46 151.17 37.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.157 -0.474 . . . . 72.31 110.848 -179.93 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.545 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -109.51 24.27 20.46 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.677 -0.773 . . . . 64.23 112.437 -179.943 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -103.17 137.51 19.28 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.527 0.68 . . . . 74.23 111.177 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.69 141.92 46.84 Favored 'Trans proline' 0 N--CA 1.465 -0.152 0 C-N-CA 122.721 2.281 . . . . 63.44 112.33 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -94.78 22.67 6.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.47 . . . . 74.45 110.908 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.141 -0.481 . . . . 73.52 111.092 179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo . . . . . 0 C--O 1.231 0.175 0 CA-C-O 120.898 0.291 . . . . 72.25 112.302 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.38 -172.18 2.83 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.182 -0.463 . . . . 72.53 110.909 179.931 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . 0.419 ' CE2' ' HB3' ' A' ' 162' ' ' PRO . 61.0 m95 -64.68 140.32 58.86 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.255 -0.43 . . . . 73.31 110.915 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.15 -2.29 12.78 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.236 -0.438 . . . . 71.34 111.184 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.6 m -72.52 -178.87 2.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.134 -0.485 . . . . 73.12 110.872 -179.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.92 -15.98 18.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.121 -0.49 . . . . 71.12 110.882 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -155.67 143.37 11.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.243 -0.435 . . . . 74.14 111.176 179.871 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 6.5 t -118.92 130.26 73.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.2 -0.455 . . . . 72.25 111.132 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 21.9 p -119.88 165.92 13.98 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.161 -0.472 . . . . 75.51 111.149 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 3.1 p90 -151.45 146.48 25.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.211 -0.449 . . . . 70.51 110.901 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 4.0 ttt180 -149.17 131.68 15.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.142 -0.481 . . . . 74.3 110.852 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.439 HD12 ' HA ' ' A' ' 106' ' ' ASP . 5.0 mp -75.27 132.87 32.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.132 -0.485 . . . . 72.4 111.162 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.428 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 22.0 t -84.99 -40.29 14.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.166 -0.47 . . . . 74.41 111.111 179.897 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 84.5 p -159.15 169.41 24.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.15 -0.477 . . . . 64.24 110.889 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 12.6 p90 -123.61 155.15 38.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.126 -0.488 . . . . 74.1 110.932 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 5.3 t -94.12 141.19 28.83 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.144 -0.48 . . . . 75.33 111.16 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.7 -18.7 1.94 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.236 -0.438 . . . . 72.14 110.894 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.25 -36.93 85.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.169 -0.468 . . . . 74.13 110.818 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.2 mt -140.15 153.47 69.16 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.54 0.686 . . . . 72.52 110.952 179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . 0.419 ' HB2' HG21 ' A' ' 103' ' ' ILE . 53.4 Cg_endo -69.81 150.98 68.63 Favored 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.629 2.219 . . . . 73.11 112.324 179.887 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 12.7 t-160 -52.22 -27.89 16.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.164 -0.471 . . . . 74.11 110.919 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.419 HG21 ' HB2' ' A' ' 101' ' ' PRO . 0.0 OUTLIER -75.03 -39.17 43.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.218 -0.446 . . . . 74.02 111.126 -179.992 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 3.0 m -69.66 -39.11 77.25 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.157 -0.474 . . . . 54.24 111.14 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 76.5 t -72.83 -46.22 53.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.187 -0.461 . . . . 73.13 111.11 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.614 ' O ' HG23 ' A' ' 109' ' ' VAL . 0.3 OUTLIER -60.74 -44.17 97.01 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.147 -0.479 . . . . 63.44 110.814 179.987 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 11.2 ptm180 -70.16 -34.11 72.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.198 -0.456 . . . . 75.02 110.838 -179.856 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.57 ' HB3' ' HD2' ' A' ' 188' ' ' PHE . 0.0 OUTLIER -61.15 -48.26 82.4 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.17 -0.468 . . . . 75.05 110.877 -179.968 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.614 HG23 ' O ' ' A' ' 106' ' ' ASP . 1.5 m -55.4 -41.61 63.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.244 -0.435 . . . . 72.31 111.087 179.846 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.469 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 10.7 t -70.11 -33.51 71.93 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.16 -0.473 . . . . 72.14 110.878 -179.847 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -61.47 -32.86 72.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.105 -0.498 . . . . 74.35 110.957 179.931 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -97.14 -40.47 8.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.196 -0.457 . . . . 74.32 111.144 179.783 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.427 ' HB2' ' HG ' ' A' ' 196' ' ' LEU . 0.4 OUTLIER -65.38 -33.88 77.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.206 -0.452 . . . . 74.11 110.956 -180.0 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 36.7 t-20 -67.55 -35.71 79.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.177 -0.465 . . . . 75.15 110.812 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' MET . . . . . 0.44 ' HB3' ' CD2' ' A' ' 226' ' ' LEU . 0.0 OUTLIER -68.25 -33.6 74.67 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.226 -0.443 . . . . 74.0 110.89 179.888 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 6.0 m95 -68.55 -44.91 73.51 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.225 -0.443 . . . . 75.23 110.966 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -73.38 -40.43 48.45 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.695 -0.764 . . . . 73.44 112.532 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 4.5 ptpt -60.76 -16.93 45.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.709 0.29 . . . . 74.42 110.897 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 27.9 mm-40 -98.26 13.51 31.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.205 -0.452 . . . . 75.55 110.902 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . 0.402 ' C ' ' H ' ' A' ' 122' ' ' LEU . 6.1 pt -147.64 150.31 36.31 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.561 0.696 . . . . 71.34 111.162 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.85 6.75 1.22 Allowed 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.662 2.242 . . . . 75.35 112.326 179.901 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.457 ' HB3' ' H ' ' A' ' 123' ' ' HIS . 10.2 mt -60.2 -160.37 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.259 -0.428 . . . . 73.22 110.882 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . 0.457 ' H ' ' HB3' ' A' ' 122' ' ' LEU . 3.4 t-160 -154.31 121.29 5.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.199 -0.455 . . . . 74.12 110.848 179.836 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 10.0 m-30 -109.33 148.74 30.55 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.173 -0.467 . . . . 75.54 110.899 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -130.69 141.73 50.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.146 -0.479 . . . . 75.14 110.827 -179.884 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.93 147.5 30.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.148 -0.478 . . . . 74.04 110.911 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 29.9 m -103.08 126.3 57.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.258 -0.428 . . . . 50.13 111.145 179.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -142.45 -10.3 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.12 -0.491 . . . . 74.43 111.17 179.854 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -154.87 109.17 2.96 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.132 -0.486 . . . . 73.32 110.905 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.68 -159.72 14.33 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.722 -0.752 . . . . 62.11 112.457 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.3 p -101.82 156.33 17.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.852 0.358 . . . . 71.11 111.11 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -111.61 165.26 12.17 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.176 -0.465 . . . . 72.32 111.053 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.06 -62.54 1.36 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.225 -0.443 . . . . 75.41 110.817 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 4.6 mp -88.68 122.53 40.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 71.04 111.167 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 135' ' ' MET . . . . . 0.428 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 14.3 mmm -100.58 125.79 46.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.149 -0.478 . . . . 72.43 110.829 179.882 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.407 ' HB ' HG13 ' A' ' 93' ' ' ILE . 0.9 OUTLIER -105.92 94.97 3.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.165 -0.47 . . . . 70.04 111.113 179.989 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -129.7 167.71 21.43 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.742 -0.742 . . . . 63.34 112.462 179.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 55.3 m-85 -105.1 145.47 30.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.849 0.357 . . . . 74.01 110.913 -179.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . 169.72 166.11 0.05 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.12 -0.491 . . . . 71.21 111.102 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . 0.414 ' HB2' ' HB3' ' A' ' 149' ' ' PHE . 0.0 OUTLIER -107.94 174.21 5.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.262 -0.426 . . . . 72.34 110.819 -179.926 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . 0.481 ' H ' ' HA ' ' A' ' 149' ' ' PHE . . . -55.67 -16.44 11.44 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.753 -0.737 . . . . 74.24 112.471 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -94.12 13.12 24.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.828 0.347 . . . . 75.03 111.113 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 3.2 p80 -79.42 -4.48 51.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.202 -0.453 . . . . 73.45 110.867 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 110.77 48.13 0.75 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.69 -0.767 . . . . 60.43 112.46 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -161.79 175.11 12.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.9 0.381 . . . . 72.14 110.818 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 69.9 p -63.81 175.22 1.19 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.154 -0.476 . . . . 64.54 110.862 -179.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 64.52 118.93 0.02 OUTLIER Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.743 0.782 . . . . 73.4 110.876 -179.882 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.72 151.18 69.26 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.654 2.236 . . . . 74.53 112.325 179.901 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 149' ' ' PHE . . . . . 0.492 ' O ' ' CG ' ' A' ' 150' ' ' ASP . 3.6 p90 -54.23 -38.38 65.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.231 -0.44 . . . . 70.0 110.844 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . 0.492 ' CG ' ' O ' ' A' ' 149' ' ' PHE . 2.7 p30 48.72 18.46 0.19 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.166 -0.47 . . . . 72.24 110.858 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . 0.42 ' C ' ' O ' ' A' ' 150' ' ' ASP . . . 36.44 -150.29 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.767 -0.73 . . . . 75.42 112.434 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.72 144.66 54.93 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.709 2.273 . . . . 75.11 112.289 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . 0.449 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 106.04 -138.14 14.18 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.737 -0.744 . . . . 70.32 112.447 179.904 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 154' ' ' ASN . . . . . 0.449 ' C ' ' O ' ' A' ' 153' ' ' GLY . 3.6 p30 -34.2 136.37 0.13 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.882 0.373 . . . . 74.45 110.881 -179.856 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 75.56 110.56 0.07 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.185 -0.461 . . . . 63.14 111.15 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 156' ' ' LEU . . . . . 0.475 HD11 HG13 ' A' ' 186' ' ' ILE . 0.4 OUTLIER -91.17 -54.32 3.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.222 -0.445 . . . . 75.02 110.896 -179.979 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . 0.545 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -163.85 148.95 10.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.22 -0.446 . . . . 73.44 111.022 179.794 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 14.5 p-80 -107.54 125.38 51.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.155 -0.475 . . . . 74.34 110.908 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -110.54 155.09 22.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.229 -0.441 . . . . 74.42 111.1 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 16.7 m-85 -106.86 151.95 24.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.246 -0.434 . . . . 75.31 110.867 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -78.52 164.75 54.29 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.626 0.727 . . . . 71.14 111.046 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 162' ' ' PRO . . . . . 0.419 ' HB3' ' CE2' ' A' ' 84' ' ' TRP . 53.2 Cg_endo -69.83 78.48 1.03 Allowed 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.688 2.259 . . . . 74.44 112.257 -179.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -130.45 119.87 2.87 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.73 -0.748 . . . . 72.32 112.422 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 50.85 -169.86 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.874 0.369 . . . . 73.1 111.101 -179.896 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -75.51 -54.57 5.45 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.752 -0.737 . . . . 74.03 112.508 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 10.1 tt -54.36 -40.15 67.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.863 0.364 . . . . 75.02 110.895 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -80.22 164.04 47.47 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.742 -0.742 . . . . 43.43 112.512 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 84.54 23.11 51.88 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.815 -0.707 . . . . 74.31 112.515 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -91.3 163.52 14.19 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.736 0.303 . . . . 63.41 110.89 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.49 130.95 55.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.225 -0.443 . . . . 74.21 111.061 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 27.3 m170 -125.1 158.55 33.58 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 72.53 110.831 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 64.0 m-85 -142.26 137.37 30.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.251 -0.432 . . . . 71.44 110.904 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 55.2 t0 -69.08 99.23 1.07 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 74.11 110.82 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.58 -16.41 10.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.152 -0.476 . . . . 74.45 110.879 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -77.86 -16.32 58.37 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.163 -0.472 . . . . 73.32 110.783 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 23.6 mm-40 -83.38 -175.65 5.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.241 -0.436 . . . . 71.41 110.898 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 1.9 mtt180 -109.8 116.79 32.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.143 -0.481 . . . . 74.32 110.917 -179.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 51.0 m95 -116.61 141.18 48.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.253 -0.43 . . . . 74.32 110.919 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 2.0 t -177.61 164.36 2.02 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.19 -0.459 . . . . 74.13 111.129 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -124.59 -68.76 0.84 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.213 -0.449 . . . . 61.52 110.881 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -70.51 -10.88 67.54 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.712 -0.756 . . . . 62.41 112.501 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 182' ' ' SER . . . . . 0.483 ' O ' ' C ' ' A' ' 183' ' ' SER . 0.2 OUTLIER -97.01 -24.29 15.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.878 0.37 . . . . 74.0 110.84 -179.723 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 183' ' ' SER . . . . . 0.483 ' C ' ' O ' ' A' ' 182' ' ' SER . 7.4 p 31.84 71.56 0.08 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.172 -0.467 . . . . 64.12 110.854 -179.877 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -117.09 -32.64 4.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.215 -0.448 . . . . 74.43 110.895 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -132.28 -127.23 2.8 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.812 -0.708 . . . . 74.22 112.529 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 186' ' ' ILE . . . . . 0.475 HG13 HD11 ' A' ' 156' ' ' LEU . 6.7 mm -79.53 99.81 3.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.823 0.344 . . . . 73.22 111.147 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -55.96 125.65 22.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.173 -0.467 . . . . 71.31 110.824 179.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 188' ' ' PHE . . . . . 0.57 ' HD2' ' HB3' ' A' ' 108' ' ' LEU . 1.1 t80 -53.85 -33.28 55.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.185 -0.461 . . . . 75.45 110.863 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.21 -47.62 70.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.193 -0.458 . . . . 60.14 110.907 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 10.1 m-30 -69.98 -40.15 75.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.228 -0.442 . . . . 74.22 110.908 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -70.22 -35.8 74.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.119 -0.491 . . . . 61.32 111.061 179.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 192' ' ' ALA . . . . . 0.436 ' O ' ' CD2' ' A' ' 196' ' ' LEU . . . -56.93 -44.66 82.69 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.26 -0.427 . . . . 52.32 111.132 179.914 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.07 -41.51 83.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.207 -0.451 . . . . 72.43 111.164 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 5.0 t-160 -72.81 -41.73 64.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 71.44 110.844 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -71.56 -48.42 48.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.164 -0.471 . . . . 71.01 111.142 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 196' ' ' LEU . . . . . 0.489 HD22 ' N ' ' A' ' 196' ' ' LEU . 4.3 mm? -64.66 -42.02 95.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.232 -0.44 . . . . 74.52 110.885 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -60.11 -29.04 67.48 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.784 -0.722 . . . . 62.43 112.438 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 198' ' ' HIS . . . . . . . . . . . . . 6.1 m-70 -69.19 -33.95 74.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.876 0.37 . . . . 75.21 110.947 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -68.92 -21.37 64.22 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.179 -0.464 . . . . 73.13 110.818 -179.794 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -88.0 -1.05 57.75 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.155 -0.475 . . . . 75.12 110.913 -179.974 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 84.3 8.97 82.75 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.721 -0.752 . . . . 50.41 112.501 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 202' ' ' MET . . . . . . . . . . . . . 97.3 mmm -71.19 159.27 34.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.885 0.374 . . . . 71.04 110.882 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -125.94 159.18 20.34 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.682 -0.77 . . . . 64.44 112.45 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 16.4 m-70 -50.67 161.05 0.37 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.842 0.354 . . . . 74.32 110.873 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -123.16 150.47 43.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.199 -0.455 . . . . 72.42 110.915 -179.832 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -87.63 -4.67 58.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.154 -0.475 . . . . 72.22 110.864 -179.817 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.55 137.96 83.41 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 121.557 0.694 . . . . 65.11 110.859 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 -7.23 20.54 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.699 2.266 . . . . 74.53 112.317 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 -128.97 30.78 5.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.24 -0.436 . . . . 63.52 110.9 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -87.11 145.7 26.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.129 -0.487 . . . . 64.4 111.149 179.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -67.77 -27.72 39.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.231 -0.44 . . . . 75.23 111.109 -179.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 81.1 mtp -97.1 8.58 44.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.167 -0.47 . . . . 75.22 110.906 179.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 213' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -55.89 114.16 6.99 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.695 0.759 . . . . 73.43 110.913 -179.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -69.72 -17.95 37.49 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.658 2.239 . . . . 63.01 112.372 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -83.98 60.22 5.72 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.2 -0.454 . . . . 74.24 111.103 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.33 0 CA-C-O 120.968 0.413 . . . . 74.42 110.939 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 8.1 t80 . . . . . 0 C--O 1.232 0.162 0 CA-C-O 120.929 0.395 . . . . 71.11 110.861 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.3 -176.87 5.2 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.137 -0.483 . . . . 65.02 110.84 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 226' ' ' LEU . . . . . 0.44 ' CD2' ' HB3' ' A' ' 115' ' ' MET . 0.7 OUTLIER -59.7 149.12 31.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.204 -0.453 . . . . 62.53 110.97 179.935 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 227' ' ' SER . . . . . . . . . . . . . 2.3 t -86.4 160.43 19.06 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.285 -0.416 . . . . 74.21 110.911 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -63.29 -64.94 0.76 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.134 -0.485 . . . . 74.54 110.925 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -55.58 -26.55 44.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.204 -0.453 . . . . 74.2 110.822 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.36 -48.63 60.69 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.314 -0.403 . . . . 74.23 110.865 -179.934 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 231' ' ' ILE . . . . . . . . . . . . . 7.6 mt -69.06 -42.92 82.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.243 -0.435 . . . . 73.41 111.168 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 232' ' ' LYS . . . . . 0.409 ' HG3' ' N ' ' A' ' 233' ' ' GLY . 0.0 OUTLIER -64.57 -32.13 73.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.167 -0.47 . . . . 73.32 110.919 179.826 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 233' ' ' GLY . . . . . 0.409 ' N ' ' HG3' ' A' ' 232' ' ' LYS . . . -63.1 -49.0 75.31 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.749 -0.738 . . . . 65.45 112.472 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 7.3 tt -72.97 -32.45 39.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.759 0.314 . . . . 74.41 111.11 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -70.12 -24.52 63.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.21 -0.45 . . . . 71.13 110.968 179.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 236' ' ' LYS . . . . . 0.418 ' HE2' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.32 -27.58 60.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.169 -0.469 . . . . 74.41 110.879 -179.991 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 237' ' ' LEU . . . . . 0.418 ' HB2' ' HE2' ' A' ' 236' ' ' LYS . 3.8 tt -97.78 -26.74 14.61 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.241 -0.436 . . . . 75.41 110.907 179.938 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 238' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -91.96 -35.2 14.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.194 -0.457 . . . . 54.42 110.985 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.293 0 C-N-CA 120.794 -0.717 . . . . 72.22 112.499 179.964 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 50.3 t-105 . . . . . 0 C--O 1.23 0.056 0 CA-C-O 120.796 0.331 . . . . 71.22 110.983 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -58.88 -35.62 73.29 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.202 -0.454 . . . . 72.51 110.884 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.09 -36.64 84.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.185 -0.461 . . . . 74.32 110.857 -179.863 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.1 -42.4 80.69 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.251 -0.432 . . . . 74.22 111.138 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.07 -43.03 62.41 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.187 -0.46 . . . . 73.12 110.927 -179.926 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -61.63 -32.44 72.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.243 -0.435 . . . . 72.4 110.938 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 8.5 m-85 -70.38 -37.07 74.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.15 -0.477 . . . . 75.11 110.953 -179.853 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -71.73 -24.54 61.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.108 -0.496 . . . . 75.43 110.869 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.43 ' HE2' ' HA ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -72.23 -42.36 65.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.238 -0.437 . . . . 75.45 110.918 179.801 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.43 ' HA ' ' HE2' ' A' ' 20' ' ' LYS . 3.2 ptm180 -67.93 -28.19 67.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.19 -0.459 . . . . 74.22 110.887 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.428 ' N ' ' HG3' ' A' ' 21' ' ' ARG . 2.0 m-85 -62.13 -25.09 67.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.199 -0.455 . . . . 75.2 110.86 -179.944 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 . . . . . 0 C--N 1.328 -0.354 0 CA-C-N 116.143 -0.48 . . . . 74.4 110.92 -179.843 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.803 0.335 . . . . 74.54 110.921 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.63 -53.12 56.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.195 -0.457 . . . . 73.13 110.843 179.944 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -59.35 -49.32 78.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.156 -0.475 . . . . 71.12 111.071 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 33.7 tttt -59.91 -38.79 83.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.225 -0.443 . . . . 74.43 110.92 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.53 -35.93 80.04 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.267 -0.424 . . . . 74.44 110.931 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 19.3 mttt -63.14 -45.17 93.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.123 -0.489 . . . . 74.2 110.951 179.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -69.48 -33.32 72.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.191 -0.458 . . . . 75.11 110.903 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.9 ttt -66.06 -47.66 73.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.137 -0.483 . . . . 63.43 110.922 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.613 ' HA ' ' CD1' ' A' ' 48' ' ' LEU . 17.4 mt-30 -58.64 -39.65 81.18 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.223 -0.444 . . . . 75.32 110.896 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.8 mmpt? -59.23 -20.57 55.19 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.248 -0.433 . . . . 75.11 110.823 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 68.8 t80 -70.42 -46.3 64.2 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.274 -0.421 . . . . 73.32 110.817 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.43 ' HB2' ' CD1' ' A' ' 48' ' ' LEU . 36.1 m-85 -81.82 -3.78 54.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.175 -0.466 . . . . 70.43 110.888 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.45 12.49 84.49 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.689 -0.767 . . . . 64.42 112.475 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.613 ' CD1' ' HA ' ' A' ' 43' ' ' GLN . 0.3 OUTLIER -59.73 140.58 89.45 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.568 0.699 . . . . 74.31 110.941 -179.936 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.8 -53.29 0.28 Allowed 'Trans proline' 0 C--O 1.231 0.159 0 C-N-CA 122.72 2.28 . . . . 74.5 112.318 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -53.33 139.25 11.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 72.24 111.032 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -129.63 126.94 39.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.133 -0.485 . . . . 73.25 111.174 179.877 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 85.07 5.69 85.62 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.735 -0.745 . . . . 64.24 112.509 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -135.05 154.63 51.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.829 0.347 . . . . 75.23 110.864 -179.942 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.8 pp -159.16 130.23 6.11 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.203 -0.453 . . . . 74.32 110.955 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 173.96 -24.38 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.132 -0.486 . . . . 61.31 110.898 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -104.09 -81.27 0.52 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 75.25 110.912 -179.888 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -84.3 -45.55 12.71 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.161 -0.472 . . . . 74.13 110.954 179.974 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.437 ' O ' HG12 ' A' ' 61' ' ' ILE . 41.3 t -57.14 -45.69 84.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.124 -0.489 . . . . 72.2 111.129 179.94 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -74.63 -30.45 25.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.163 -0.472 . . . . 75.2 111.105 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -59.62 -40.47 87.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.174 -0.466 . . . . 73.45 110.832 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.437 HG12 ' O ' ' A' ' 58' ' ' VAL . 0.5 OUTLIER -68.43 -29.43 44.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.156 -0.474 . . . . 74.52 111.115 -179.968 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 6.9 mtt -65.19 -32.68 74.48 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.161 -0.472 . . . . 74.01 110.932 179.775 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -100.66 -26.48 13.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.16 -0.473 . . . . 45.15 110.913 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.35 119.01 71.89 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.52 0.676 . . . . 75.32 110.932 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.71 143.36 50.83 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.706 2.271 . . . . 72.11 112.33 179.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 2.0 ppt_? -155.73 -53.73 0.09 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.192 -0.458 . . . . 73.22 110.882 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 6.4 t -139.42 123.88 18.23 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.163 -0.471 . . . . 72.31 110.928 -179.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.534 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -79.33 -36.91 25.81 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.747 -0.739 . . . . 64.23 112.462 -179.888 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 1.1 t -64.71 146.45 98.45 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-O 121.592 0.71 . . . . 74.23 111.209 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -69.81 159.85 51.84 Favored 'Trans proline' 0 C--O 1.231 0.166 0 C-N-CA 122.675 2.25 . . . . 63.44 112.302 -180.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -85.0 -0.29 53.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.219 -0.446 . . . . 74.45 110.876 179.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.9 m . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.199 -0.455 . . . . 73.52 111.095 -179.954 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo . . . . . 0 C--O 1.232 0.195 0 CA-C-O 120.865 0.277 . . . . 72.25 112.316 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 4.2 mtpt -88.98 150.72 22.68 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.229 -0.441 . . . . 72.53 110.906 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . 0.477 ' N ' ' HH ' ' A' ' 238' ' ' TYR . 95.6 m95 -50.96 132.54 27.24 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.324 -0.398 . . . . 73.31 110.935 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -114.48 -10.66 12.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.307 -0.406 . . . . 71.34 111.147 -179.916 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -64.85 -176.77 0.29 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.241 -0.436 . . . . 73.12 110.909 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 9.7 mptt -99.39 -11.14 21.43 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.116 -0.493 . . . . 71.12 110.885 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -156.19 142.1 10.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.172 -0.467 . . . . 74.14 111.141 179.877 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 90.5 t -118.46 130.51 73.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.101 -0.499 . . . . 72.25 111.156 179.865 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -115.95 161.57 18.64 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.202 -0.453 . . . . 75.51 111.128 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 4.6 p90 -149.37 147.16 27.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 70.51 110.88 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -150.07 138.86 20.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.103 -0.498 . . . . 74.3 110.96 -179.946 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.0 mm -78.29 133.48 30.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.24 -0.436 . . . . 72.4 111.169 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.481 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 18.8 t -86.91 -40.47 14.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.194 -0.457 . . . . 74.41 111.201 179.825 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 2.9 t -143.67 169.38 17.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.128 -0.487 . . . . 64.24 110.859 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 8.8 p90 -111.62 148.88 32.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.165 -0.47 . . . . 74.1 110.926 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' THR . . . . . 0.468 ' O ' ' O ' ' A' ' 100' ' ' LEU . 0.2 OUTLIER -82.91 141.05 32.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.071 -0.513 . . . . 75.33 111.134 -179.986 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 2.8 ppt_? -71.7 -8.76 56.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.209 -0.45 . . . . 72.14 110.799 -179.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -96.6 -25.79 15.47 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.199 -0.455 . . . . 74.13 110.876 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.468 ' O ' ' O ' ' A' ' 97' ' ' THR . 1.1 mp -137.68 152.45 72.68 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.618 0.723 . . . . 72.52 110.927 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . 0.401 ' HB2' HG21 ' A' ' 103' ' ' ILE . 53.9 Cg_endo -69.73 150.95 69.1 Favored 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 122.701 2.268 . . . . 73.11 112.309 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 4.7 t-160 -52.06 -25.59 9.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.455 . . . . 74.11 110.837 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.401 HG21 ' HB2' ' A' ' 101' ' ' PRO . 11.7 tt -77.26 -37.47 25.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.263 -0.426 . . . . 74.02 111.143 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 3.4 m -68.94 -39.19 79.71 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.174 -0.467 . . . . 54.24 111.13 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 81.1 t -71.76 -45.74 64.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.212 -0.449 . . . . 73.13 111.145 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.592 ' O ' HG23 ' A' ' 109' ' ' VAL . 16.0 t0 -62.61 -39.53 94.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.208 -0.451 . . . . 63.44 110.917 179.927 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . 0.513 ' HG3' ' N ' ' A' ' 108' ' ' LEU . 0.0 OUTLIER -70.57 -33.8 71.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.168 -0.469 . . . . 75.02 110.926 179.996 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.513 ' N ' ' HG3' ' A' ' 107' ' ' ARG . 0.0 OUTLIER -65.61 -49.56 68.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.202 -0.453 . . . . 75.05 110.934 -179.971 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.592 HG23 ' O ' ' A' ' 106' ' ' ASP . 1.6 m -55.83 -42.93 72.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.183 -0.462 . . . . 72.31 111.059 179.877 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.489 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 44.6 t -70.2 -34.17 72.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.13 -0.487 . . . . 72.14 110.903 -179.824 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.16 -33.25 74.16 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.105 -0.498 . . . . 74.35 110.942 179.878 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.43 -40.28 9.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.272 -0.422 . . . . 74.32 111.16 179.755 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.435 HD13 HD13 ' A' ' 196' ' ' LEU . 0.4 OUTLIER -65.59 -33.2 75.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 74.11 110.949 179.97 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -69.59 -44.42 70.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.15 -0.477 . . . . 75.15 110.87 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.84 -34.86 70.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.207 -0.452 . . . . 74.0 110.843 179.936 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 5.1 m95 -62.53 -47.44 83.91 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.287 -0.415 . . . . 75.23 110.91 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' GLY . . . . . 0.481 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -72.97 -32.77 60.41 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.745 -0.741 . . . . 73.44 112.507 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.0 mmpt? -62.98 -14.3 45.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.842 0.353 . . . . 74.42 110.971 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . 0.413 ' HG2' HG12 ' A' ' 231' ' ' ILE . 0.9 OUTLIER -104.65 13.71 31.07 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.112 -0.495 . . . . 75.55 110.906 179.904 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . 0.481 ' CG1' ' HA2' ' A' ' 117' ' ' GLY . 5.8 pt -146.91 156.29 47.61 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.707 0.765 . . . . 71.34 111.063 -179.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.83 2.14 3.84 Favored 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 122.701 2.267 . . . . 75.35 112.333 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 7.1 mt -60.96 -157.42 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.219 -0.446 . . . . 73.22 110.892 179.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 5.0 t60 -163.63 138.47 6.15 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.158 -0.474 . . . . 74.12 110.822 179.818 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 37.3 m-85 -120.88 148.83 43.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.195 -0.457 . . . . 75.54 110.902 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.4 141.22 51.48 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.204 -0.453 . . . . 75.14 110.877 -179.879 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.51 140.04 36.07 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.219 -0.446 . . . . 74.04 110.84 179.973 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 15.0 m -102.56 131.48 50.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.188 -0.46 . . . . 50.13 111.149 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -143.93 -22.33 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 74.43 111.122 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -138.6 109.19 6.58 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.151 -0.477 . . . . 73.32 110.91 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.67 -159.59 14.4 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.655 -0.783 . . . . 62.11 112.49 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.87 155.71 17.98 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.788 0.327 . . . . 71.11 111.115 -179.86 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -112.08 165.19 12.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.209 -0.45 . . . . 72.32 111.128 179.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -65.89 -62.61 1.4 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.23 -0.441 . . . . 75.41 110.888 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 53.6 mt -86.59 132.25 32.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.21 -0.45 . . . . 71.04 111.142 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 135' ' ' MET . . . . . 0.481 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 18.4 mmm -110.64 123.1 49.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.214 -0.448 . . . . 72.43 110.892 179.846 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -106.54 92.87 2.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.256 -0.429 . . . . 70.04 111.133 179.983 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . 0.427 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -135.56 162.58 24.91 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.783 -0.722 . . . . 63.34 112.491 179.911 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -105.25 142.53 34.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.856 0.36 . . . . 74.01 110.918 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . 179.74 168.02 1.18 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.199 -0.455 . . . . 71.21 111.107 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 38.3 mtm180 -103.29 173.43 6.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.226 -0.443 . . . . 72.34 110.899 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -52.8 -19.06 6.31 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.755 -0.736 . . . . 74.24 112.495 -179.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -87.89 13.36 10.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.857 0.36 . . . . 75.03 111.127 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 11.0 p80 -77.05 -22.02 53.59 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.17 -0.468 . . . . 73.45 110.823 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 138.18 52.67 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.798 -0.715 . . . . 60.43 112.509 -179.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 34.4 p-10 -173.36 156.59 3.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.885 0.374 . . . . 72.14 110.815 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 9.7 m -71.69 173.48 8.07 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.124 -0.489 . . . . 64.54 110.859 -179.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 147' ' ' TYR . . . . . 0.405 ' HA ' ' HD2' ' A' ' 148' ' ' PRO . 0.1 OUTLIER 63.1 106.82 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.571 0.7 . . . . 73.4 110.902 -179.887 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 148' ' ' PRO . . . . . 0.405 ' HD2' ' HA ' ' A' ' 147' ' ' TYR . 54.4 Cg_endo -69.71 143.54 51.41 Favored 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.717 2.278 . . . . 74.53 112.353 179.887 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 149' ' ' PHE . . . . . 0.449 ' CE1' ' HB2' ' A' ' 173' ' ' ASP . 0.1 OUTLIER -64.2 -14.7 57.03 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.247 -0.433 . . . . 70.0 110.931 179.943 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 75.6 -4.11 2.44 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.127 -0.488 . . . . 72.24 110.85 179.934 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 66.92 -137.96 34.48 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.711 -0.757 . . . . 75.42 112.515 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.72 141.33 45.08 Favored 'Trans proline' 0 C--O 1.231 0.144 0 C-N-CA 122.699 2.266 . . . . 75.11 112.37 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 103.4 -144.9 16.07 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.778 -0.725 . . . . 70.32 112.456 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -39.01 150.19 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.967 0.413 . . . . 74.45 110.88 -179.834 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 75.24 103.71 0.07 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.163 -0.471 . . . . 63.14 111.129 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 156' ' ' LEU . . . . . 0.45 HD12 HG13 ' A' ' 186' ' ' ILE . 0.5 OUTLIER -87.08 -54.98 4.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.224 -0.444 . . . . 75.02 110.96 179.911 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . 0.534 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -162.11 148.47 13.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.471 . . . . 73.44 111.045 179.76 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 32.0 p-80 -112.28 118.74 36.11 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.143 -0.48 . . . . 74.34 110.821 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -111.16 150.18 29.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 74.42 111.098 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -120.65 172.83 7.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.183 -0.462 . . . . 75.31 110.904 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -104.12 164.26 15.67 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.591 0.71 . . . . 71.14 111.133 179.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.8 88.49 0.54 Allowed 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.68 2.254 . . . . 74.44 112.38 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -124.27 120.44 4.07 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.798 -0.715 . . . . 72.32 112.53 179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 2.3 m 73.41 -68.33 0.23 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.823 0.344 . . . . 73.1 111.175 -179.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . 176.46 -61.67 0.1 Allowed Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.714 -0.755 . . . . 74.03 112.442 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 9.7 tt -53.95 -30.99 49.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.854 0.359 . . . . 75.02 110.897 -179.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -72.43 -173.87 22.97 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.765 -0.731 . . . . 43.43 112.465 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 73.01 22.93 78.75 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.69 -0.767 . . . . 74.31 112.498 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -100.44 161.6 13.49 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.859 0.362 . . . . 63.41 110.882 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.56 130.76 55.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.204 -0.453 . . . . 74.21 111.024 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 48.3 m170 -127.0 132.74 50.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.181 -0.463 . . . . 72.53 110.862 -180.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 38.0 m-85 -116.13 138.86 50.88 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.238 -0.437 . . . . 71.44 110.883 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 173' ' ' ASP . . . . . 0.449 ' HB2' ' CE1' ' A' ' 149' ' ' PHE . 11.1 t0 -64.92 95.19 0.15 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 74.11 110.858 179.983 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 2.9 pp20? -55.64 -18.7 8.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.23 -0.441 . . . . 74.45 110.904 -179.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.82 -22.73 42.68 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.177 -0.465 . . . . 73.32 110.884 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 176' ' ' GLU . . . . . 0.402 ' HG3' HD13 ' A' ' 156' ' ' LEU . 0.0 OUTLIER -72.73 -170.99 0.76 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 71.41 110.89 -179.926 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -116.57 114.37 24.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.166 -0.47 . . . . 74.32 110.909 -179.88 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 48.6 m95 -116.77 142.77 46.49 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.173 -0.467 . . . . 74.32 111.014 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 13.1 t -177.66 163.57 1.91 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.279 -0.419 . . . . 74.13 111.183 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -125.0 -68.86 0.82 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.22 -0.445 . . . . 61.52 110.913 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -63.6 -13.13 49.79 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.736 -0.745 . . . . 62.41 112.555 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 182' ' ' SER . . . . . 0.402 ' O ' ' C ' ' A' ' 183' ' ' SER . 0.3 OUTLIER -93.48 -24.39 18.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.917 0.389 . . . . 74.0 110.877 -179.8 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 183' ' ' SER . . . . . 0.402 ' C ' ' O ' ' A' ' 182' ' ' SER . 7.4 p 37.97 43.78 0.56 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.091 -0.504 . . . . 64.12 110.854 -179.809 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 1.2 tt -107.51 -33.39 7.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.104 -0.498 . . . . 74.43 110.91 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -113.42 -145.58 9.3 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.736 -0.745 . . . . 74.22 112.485 179.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 186' ' ' ILE . . . . . 0.45 HG13 HD12 ' A' ' 156' ' ' LEU . 8.2 mm -79.03 99.54 3.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.893 0.377 . . . . 73.22 111.125 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -44.27 123.85 3.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.466 . . . . 71.31 110.873 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 188' ' ' PHE . . . . . 0.509 ' HD2' ' HB3' ' A' ' 108' ' ' LEU . 1.4 t80 -59.83 -38.45 82.06 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.098 -0.501 . . . . 75.45 110.872 -179.92 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . 0.424 HD22 HD13 ' A' ' 108' ' ' LEU . 0.0 OUTLIER -67.34 -47.61 69.97 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.129 -0.487 . . . . 60.14 110.895 179.984 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 65.6 t80 -67.54 -39.86 84.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.248 -0.433 . . . . 74.22 110.931 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -72.5 -35.21 68.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.091 -0.504 . . . . 61.32 111.121 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 192' ' ' ALA . . . . . 0.503 ' O ' ' HB2' ' A' ' 196' ' ' LEU . . . -57.37 -44.69 84.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 52.32 111.079 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 13.6 m -58.28 -43.41 88.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.225 -0.443 . . . . 72.43 111.137 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 34.1 t60 -72.82 -42.97 63.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.2 -0.455 . . . . 71.44 110.863 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -69.87 -47.72 61.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.221 -0.445 . . . . 71.01 111.106 179.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 196' ' ' LEU . . . . . 0.507 ' N ' HD23 ' A' ' 196' ' ' LEU . 4.5 mm? -64.62 -33.58 76.28 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.217 -0.447 . . . . 74.52 110.865 -179.942 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -63.58 -26.55 69.85 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.701 -0.761 . . . . 62.43 112.475 179.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 198' ' ' HIS . . . . . . . . . . . . . 4.3 m-70 -67.07 -42.66 84.31 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.825 0.345 . . . . 75.21 110.813 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -61.85 -20.53 63.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.225 -0.443 . . . . 73.13 110.865 -179.755 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 1.7 mt -86.37 3.2 44.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.091 -0.504 . . . . 75.12 110.872 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 84.1 -9.35 63.79 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.714 -0.755 . . . . 50.41 112.466 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 202' ' ' MET . . . . . . . . . . . . . 42.1 tpp -54.72 153.93 5.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.847 0.356 . . . . 71.04 110.914 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -117.68 177.97 16.79 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.699 -0.762 . . . . 64.44 112.467 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 45.6 m-70 -77.92 149.97 34.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.799 0.333 . . . . 74.32 110.833 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 66.2 m -121.86 149.91 42.69 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.18 -0.463 . . . . 72.42 110.835 -179.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 79.1 p -87.79 -4.37 58.88 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.126 -0.488 . . . . 72.22 110.849 -179.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -71.62 130.45 87.23 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.614 0.721 . . . . 65.11 110.858 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.72 -8.28 23.19 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.688 2.258 . . . . 74.53 112.351 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -116.26 11.09 15.0 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.145 -0.48 . . . . 63.52 110.915 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 210' ' ' ALA . . . . . 0.415 ' O ' ' HB2' ' A' ' 213' ' ' TYR . . . -87.18 146.02 26.18 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.132 -0.486 . . . . 64.4 111.088 179.838 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 211' ' ' VAL . . . . . 0.456 HG12 ' HG3' ' A' ' 212' ' ' MET . 0.4 OUTLIER -70.47 -25.07 26.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.196 -0.456 . . . . 75.23 111.104 179.902 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 212' ' ' MET . . . . . 0.456 ' HG3' HG12 ' A' ' 211' ' ' VAL . 0.4 OUTLIER -86.35 3.19 44.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.199 -0.455 . . . . 75.22 110.901 179.937 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 213' ' ' TYR . . . . . 0.415 ' HB2' ' O ' ' A' ' 210' ' ' ALA . 2.0 t80 -54.85 110.23 2.05 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-O 121.636 0.731 . . . . 73.43 110.887 -179.88 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.77 -18.55 36.89 Favored 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.705 2.27 . . . . 63.01 112.41 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.27 53.6 2.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.184 -0.462 . . . . 74.24 111.116 -179.959 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 5.6 t80 . . . . . 0 C--N 1.328 -0.351 0 CA-C-N 116.26 -0.427 . . . . 74.42 110.914 -179.93 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.913 0.387 . . . . 71.11 110.841 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.37 147.89 35.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.11 -0.495 . . . . 65.02 110.917 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 10.1 mt -75.45 148.92 38.68 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.203 -0.453 . . . . 62.53 110.924 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 227' ' ' SER . . . . . 0.413 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 2.1 t -87.2 155.3 20.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.241 -0.436 . . . . 74.21 110.84 -179.926 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -64.11 -66.25 0.57 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.099 -0.5 . . . . 74.54 110.957 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -55.69 -25.62 40.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.181 -0.463 . . . . 74.2 110.904 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -68.84 -48.45 63.45 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.169 -0.469 . . . . 74.23 110.855 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 231' ' ' ILE . . . . . 0.413 HG12 ' HG2' ' A' ' 119' ' ' GLU . 12.0 mt -68.21 -42.26 84.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.231 -0.44 . . . . 73.41 111.067 180.0 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 15.2 pttm -65.9 -32.14 73.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.199 -0.455 . . . . 73.32 110.929 179.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -62.62 -46.63 93.34 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.756 -0.735 . . . . 65.45 112.472 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 12.2 tt -72.93 -30.54 32.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.779 0.323 . . . . 74.41 111.101 -179.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -70.96 -24.71 62.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.174 -0.466 . . . . 71.13 110.879 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 236' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.1 -26.82 60.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.218 -0.446 . . . . 74.41 110.903 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 237' ' ' LEU . . . . . . . . . . . . . 10.3 tt -97.25 -24.54 15.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.224 -0.443 . . . . 75.41 110.937 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 238' ' ' TYR . . . . . 0.477 ' HH ' ' N ' ' A' ' 84' ' ' TRP . 6.3 m-85 -92.36 -35.07 13.92 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.228 -0.442 . . . . 54.42 110.913 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.28 0 C-N-CA 120.791 -0.718 . . . . 72.22 112.524 179.988 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 11.6 t-105 . . . . . 0 C--O 1.23 0.049 0 CA-C-O 120.764 0.316 . . . . 71.22 110.954 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -73.28 -35.37 66.15 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.217 -0.447 . . . . 72.51 110.861 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -62.96 -36.92 85.06 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.229 -0.441 . . . . 74.32 110.92 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.16 -41.2 87.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 74.22 111.078 179.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -72.92 -42.99 62.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.245 -0.434 . . . . 73.12 110.911 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -65.86 -31.82 72.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.219 -0.446 . . . . 72.4 110.847 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -70.33 -35.86 73.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.172 -0.467 . . . . 75.11 110.85 -179.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.9 mt -71.06 -21.03 62.3 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.157 -0.474 . . . . 75.43 110.952 179.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.0 ptmt -75.35 -29.88 60.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.128 -0.487 . . . . 75.45 110.856 179.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.7 ptp180 -86.2 -27.22 24.65 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.259 -0.428 . . . . 74.22 110.839 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -59.62 -21.24 60.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.207 -0.451 . . . . 75.2 110.885 -179.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 . . . . . 0 C--N 1.328 -0.363 0 CA-C-N 116.164 -0.471 . . . . 74.4 110.939 -179.89 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.423 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 8.6 tt . . . . . 0 C--O 1.23 0.056 0 CA-C-O 120.74 0.305 . . . . 74.54 110.885 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.44 -51.25 70.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.204 -0.453 . . . . 73.13 110.894 179.918 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -66.04 -36.6 83.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.171 -0.468 . . . . 71.12 111.126 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.419 ' O ' ' HG3' ' A' ' 41' ' ' GLU . 0.0 OUTLIER -65.59 -49.08 70.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.447 . . . . 74.43 110.912 179.934 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.423 ' HG ' ' O ' ' A' ' 35' ' ' LEU . 4.6 mt -63.19 -35.38 80.11 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.156 -0.475 . . . . 74.44 110.914 179.924 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.8 tttt -68.48 -45.73 71.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.249 -0.432 . . . . 74.2 110.876 179.83 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.557 ' HG3' ' N ' ' A' ' 42' ' ' MET . 0.0 OUTLIER -59.93 -31.87 70.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.193 -0.458 . . . . 75.11 110.946 179.949 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.557 ' N ' ' HG3' ' A' ' 41' ' ' GLU . 38.2 ttp -68.5 -34.09 75.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.142 -0.481 . . . . 63.43 110.901 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.418 ' HG3' ' HA ' ' A' ' 51' ' ' THR . 1.2 mm-40 -60.65 -39.44 88.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.209 -0.45 . . . . 75.32 110.92 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.1 mmpt? -68.37 -28.36 67.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.47 . . . . 75.11 110.874 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 28.1 t80 -70.28 -45.01 67.2 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.18 -0.464 . . . . 73.32 110.86 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 17.2 m-85 -81.98 -35.12 29.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.174 -0.466 . . . . 70.43 110.913 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 102.73 -7.13 52.9 Favored Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.75 -0.738 . . . . 64.42 112.466 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -59.82 138.78 90.33 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.565 0.697 . . . . 74.31 110.968 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.73 -53.01 0.29 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.651 2.234 . . . . 74.5 112.374 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -51.32 108.22 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.215 -0.448 . . . . 72.24 111.126 179.881 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.418 ' HA ' ' HG3' ' A' ' 43' ' ' GLN . 41.4 p -109.0 164.37 12.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.178 -0.464 . . . . 73.25 111.118 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 59.56 17.65 41.62 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.723 -0.751 . . . . 64.24 112.475 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -114.57 161.05 18.56 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.857 0.361 . . . . 75.23 110.837 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 26.8 tp -168.56 84.99 0.17 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.206 -0.452 . . . . 74.32 110.903 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.4 p30 175.55 -29.24 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.148 -0.478 . . . . 61.31 110.91 179.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 28.5 t -90.84 -100.52 0.1 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.156 -0.474 . . . . 75.25 110.902 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -85.05 -28.89 25.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.155 -0.475 . . . . 74.13 110.884 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.421 ' O ' HG12 ' A' ' 61' ' ' ILE . 66.6 t -64.98 -41.56 92.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.188 -0.46 . . . . 72.2 111.103 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -74.59 -31.45 27.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.206 -0.452 . . . . 75.2 111.164 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.03 -33.09 70.34 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.121 -0.49 . . . . 73.45 110.91 179.925 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.421 HG12 ' O ' ' A' ' 58' ' ' VAL . 0.4 OUTLIER -76.45 -29.56 18.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.125 -0.489 . . . . 74.52 111.093 -179.975 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 5.2 mmt -64.41 -37.35 87.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.144 -0.48 . . . . 74.01 110.88 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -86.58 -23.29 25.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.26 -0.427 . . . . 45.15 110.918 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -85.08 124.97 71.58 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.588 0.709 . . . . 75.32 110.842 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 160.49 49.51 Favored 'Trans proline' 0 C--O 1.233 0.254 0 C-N-CA 122.683 2.255 . . . . 72.11 112.406 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -155.53 -77.46 0.1 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.31 -0.405 . . . . 73.22 110.914 -179.957 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -145.18 155.18 43.13 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.119 -0.491 . . . . 72.31 110.843 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.583 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -97.53 11.81 64.86 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.727 -0.749 . . . . 64.23 112.534 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.436 ' CG1' ' HD2' ' A' ' 70' ' ' PRO . 0.9 OUTLIER -92.37 136.47 25.51 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.703 0.763 . . . . 74.23 111.139 -179.958 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . 0.436 ' HD2' ' CG1' ' A' ' 69' ' ' VAL . 54.1 Cg_endo -69.75 155.1 66.87 Favored 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.691 2.26 . . . . 63.44 112.338 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -92.66 15.49 14.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.224 -0.444 . . . . 74.45 110.88 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.183 -0.462 . . . . 73.52 111.108 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo . . . . . 0 N--CA 1.465 -0.151 0 CA-C-O 120.898 0.291 . . . . 72.25 112.378 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 2.6 mttm -84.08 161.74 20.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.157 -0.474 . . . . 72.53 110.895 179.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . 0.442 ' NE1' ' O ' ' A' ' 199' ' ' SER . 40.6 m0 -49.63 123.48 7.87 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.158 -0.474 . . . . 73.31 110.983 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 9.9 t -115.19 -19.43 10.82 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.241 -0.436 . . . . 71.34 111.128 -179.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -53.46 160.98 1.08 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.216 -0.447 . . . . 73.12 110.832 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 2.8 ptmt -74.03 -30.61 62.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.064 -0.516 . . . . 71.12 110.892 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -152.72 144.54 15.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.235 -0.439 . . . . 74.14 111.105 179.938 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 12.2 t -130.77 140.95 47.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.22 -0.445 . . . . 72.25 111.101 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 11.0 p -117.18 167.94 10.74 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.088 -0.505 . . . . 75.51 111.128 -180.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.403 ' HB3' ' HB ' ' A' ' 134' ' ' ILE . 4.9 p90 -150.35 146.55 26.8 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.198 -0.456 . . . . 70.51 110.961 -179.856 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 4.5 ttt-85 -146.29 136.24 23.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.165 -0.471 . . . . 74.3 110.854 -179.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.43 HD12 ' HA ' ' A' ' 106' ' ' ASP . 3.4 mp -74.76 135.54 27.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.169 -0.469 . . . . 72.4 111.195 179.903 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.402 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 19.3 t -89.15 -40.7 13.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.2 -0.454 . . . . 74.41 111.112 179.914 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 5.6 t -144.56 163.4 34.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.208 -0.451 . . . . 64.24 110.857 -179.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 11.2 p90 -110.58 152.47 26.39 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.138 -0.483 . . . . 74.1 110.921 -179.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' THR . . . . . 0.448 ' O ' ' O ' ' A' ' 100' ' ' LEU . 0.2 OUTLIER -82.68 140.99 32.8 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.117 -0.492 . . . . 75.33 111.173 -179.989 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.92 -7.8 52.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.197 -0.456 . . . . 72.14 110.923 179.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -96.42 -26.1 15.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.251 -0.431 . . . . 74.13 110.889 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.448 ' O ' ' O ' ' A' ' 97' ' ' THR . 0.9 OUTLIER -133.54 153.6 80.38 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.591 0.71 . . . . 72.52 111.006 -179.956 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . 0.4 ' HB2' HG23 ' A' ' 103' ' ' ILE . 53.9 Cg_endo -69.71 150.89 69.13 Favored 'Trans proline' 0 C--O 1.231 0.159 0 C-N-CA 122.703 2.269 . . . . 73.11 112.365 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 15.9 t-160 -52.74 -27.38 17.46 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.221 -0.445 . . . . 74.11 110.866 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.4 HG23 ' HB2' ' A' ' 101' ' ' PRO . 0.0 OUTLIER -75.72 -39.43 39.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.18 -0.463 . . . . 74.02 111.109 -179.956 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 3.1 m -69.33 -39.13 78.37 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.114 -0.493 . . . . 54.24 111.154 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 92.0 t -72.61 -44.83 60.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.224 -0.444 . . . . 73.13 111.119 179.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.582 ' O ' HG21 ' A' ' 109' ' ' VAL . 3.9 t0 -66.25 -41.91 89.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.215 -0.448 . . . . 63.44 110.841 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 6.6 ptm180 -69.9 -33.8 72.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 75.02 110.829 -179.839 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.554 ' HB3' ' HD2' ' A' ' 188' ' ' PHE . 0.0 OUTLIER -60.73 -48.95 79.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.196 -0.456 . . . . 75.05 110.882 -179.96 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.582 HG21 ' O ' ' A' ' 106' ' ' ASP . 1.3 m -55.61 -41.96 66.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.181 -0.463 . . . . 72.31 111.112 179.893 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.469 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 42.7 t -69.97 -34.1 72.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.142 -0.481 . . . . 72.14 110.874 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.46 -33.33 74.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.111 -0.495 . . . . 74.35 110.882 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -94.02 -40.97 9.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.288 -0.415 . . . . 74.32 111.12 179.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.47 -32.91 74.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.179 -0.464 . . . . 74.11 110.969 179.937 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -67.9 -38.06 82.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.226 -0.443 . . . . 75.15 110.946 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.41 -34.62 77.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.083 -0.508 . . . . 74.0 110.881 179.871 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' TRP . . . . . 0.41 ' CZ3' ' SD ' ' A' ' 202' ' ' MET . 8.4 m95 -65.98 -52.29 50.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.198 -0.455 . . . . 75.23 110.929 -179.968 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -63.94 -37.22 94.31 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.728 -0.749 . . . . 73.44 112.453 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.41 -16.31 45.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.758 0.313 . . . . 74.42 110.888 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . 0.433 ' HG2' HD13 ' A' ' 226' ' ' LEU . 0.2 OUTLIER -101.2 12.13 38.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.278 -0.419 . . . . 75.55 110.938 179.938 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . 0.526 ' C ' ' H ' ' A' ' 122' ' ' LEU . 5.1 pt -149.7 149.36 28.07 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.59 0.709 . . . . 71.34 111.113 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.72 25.71 0.17 Allowed 'Trans proline' 0 C--O 1.231 0.166 0 C-N-CA 122.668 2.245 . . . . 75.35 112.354 179.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.526 ' H ' ' C ' ' A' ' 120' ' ' ILE . 9.9 mt -80.43 -157.53 0.15 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.193 -0.458 . . . . 73.22 110.908 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . 0.416 ' H ' ' HB3' ' A' ' 122' ' ' LEU . 4.2 t60 -163.78 133.59 4.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 74.12 110.855 179.868 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 23.4 m-30 -119.59 142.58 48.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.242 -0.436 . . . . 75.54 110.899 -179.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -118.85 141.92 48.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.157 -0.474 . . . . 75.14 110.916 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.42 149.48 30.13 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.133 -0.485 . . . . 74.04 110.896 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . 0.403 HG13 ' CB ' ' A' ' 132' ' ' ALA . 27.4 m -103.21 126.5 57.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.267 -0.424 . . . . 50.13 111.086 179.933 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -143.55 -11.79 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.237 -0.438 . . . . 74.43 111.18 179.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -153.78 109.22 3.2 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.178 -0.464 . . . . 73.32 110.931 179.967 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.59 -161.2 13.69 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.745 -0.74 . . . . 62.11 112.445 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -101.82 155.97 17.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.767 0.317 . . . . 71.11 111.117 -179.818 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . 0.403 ' CB ' HG13 ' A' ' 127' ' ' VAL . . . -111.93 165.3 12.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 72.32 111.132 179.84 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -75.9 -62.02 1.73 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.202 -0.454 . . . . 75.41 110.869 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . 0.521 ' CD1' ' N ' ' A' ' 134' ' ' ILE . 1.3 mp -82.57 107.5 14.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.254 -0.43 . . . . 71.04 111.117 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 135' ' ' MET . . . . . 0.402 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 11.1 mmm -92.94 131.78 37.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.221 -0.445 . . . . 72.43 110.876 179.797 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.415 HD11 HG21 ' A' ' 134' ' ' ILE . 0.3 OUTLIER -113.34 95.33 3.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.251 -0.432 . . . . 70.04 111.141 179.956 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -136.1 165.51 24.88 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.796 -0.716 . . . . 63.34 112.499 179.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 43.5 m-85 -106.42 149.68 26.79 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.859 0.361 . . . . 74.01 110.861 -179.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . 170.49 166.42 0.07 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.138 -0.483 . . . . 71.21 111.113 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -104.6 173.53 6.26 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.213 -0.449 . . . . 72.34 110.87 -179.916 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -55.13 -17.45 10.54 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.797 -0.716 . . . . 74.24 112.454 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -87.33 12.97 10.68 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.795 0.331 . . . . 75.03 111.086 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 6.1 p80 -81.44 -4.38 55.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.235 -0.438 . . . . 73.45 110.788 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 124.68 7.31 6.23 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.778 -0.725 . . . . 60.43 112.521 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 29.1 m-20 -111.19 163.64 13.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.856 0.36 . . . . 72.14 110.854 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -87.44 176.89 7.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.173 -0.467 . . . . 64.54 110.854 -179.74 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 66.46 127.98 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.687 0.755 . . . . 73.4 110.933 -179.921 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.87 145.42 56.45 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.677 2.251 . . . . 74.53 112.332 179.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 149' ' ' PHE . . . . . 0.41 ' CE1' ' HB2' ' A' ' 173' ' ' ASP . 0.1 OUTLIER -90.87 -31.61 16.37 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.186 -0.461 . . . . 70.0 110.894 -179.985 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 74.39 -1.67 3.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.145 -0.48 . . . . 72.24 110.855 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 50.04 -108.52 0.5 Allowed Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.721 -0.752 . . . . 75.42 112.48 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -69.71 139.41 40.33 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.707 2.271 . . . . 75.11 112.401 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 103.29 -153.76 18.06 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.712 -0.756 . . . . 70.32 112.484 179.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 154' ' ' ASN . . . . . 0.412 ' O ' ' CB ' ' A' ' 155' ' ' THR . 4.4 p30 -42.77 155.06 0.06 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.904 0.383 . . . . 74.45 110.872 -179.883 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 155' ' ' THR . . . . . 0.412 ' CB ' ' O ' ' A' ' 154' ' ' ASN . 0.2 OUTLIER 78.44 114.01 0.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.152 -0.476 . . . . 63.14 111.182 -179.95 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 156' ' ' LEU . . . . . 0.441 HD13 HG13 ' A' ' 186' ' ' ILE . 1.1 tp -101.49 -51.79 3.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.22 -0.446 . . . . 75.02 110.94 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . 0.583 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -159.65 148.46 17.74 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.11 -0.495 . . . . 73.44 111.113 179.812 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 37.0 p-80 -110.32 123.2 49.39 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.215 -0.448 . . . . 74.34 110.868 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -110.36 160.17 16.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.263 -0.426 . . . . 74.42 111.115 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 16.6 m-30 -118.91 163.32 17.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.205 -0.452 . . . . 75.31 110.852 -179.894 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -88.09 165.02 31.22 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.543 0.687 . . . . 71.14 111.127 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 162' ' ' PRO . . . . . 0.46 ' HD3' ' O ' ' A' ' 199' ' ' SER . 53.6 Cg_endo -69.76 71.61 1.51 Allowed 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.629 2.219 . . . . 74.44 112.377 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -127.91 108.82 0.97 Allowed Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.77 -0.729 . . . . 72.32 112.491 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 1.4 p 59.23 173.74 0.07 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.79 0.329 . . . . 73.1 111.104 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -55.59 -33.74 59.56 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.667 -0.778 . . . . 74.03 112.514 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -71.28 -18.03 62.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.83 0.348 . . . . 75.02 110.89 -179.929 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -88.93 167.29 34.56 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.762 -0.732 . . . . 43.43 112.559 179.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 168' ' ' GLY . . . . . 0.442 ' O ' HG13 ' A' ' 134' ' ' ILE . . . 72.95 15.83 78.36 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.772 -0.728 . . . . 74.31 112.468 -179.893 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -85.76 141.36 29.74 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.823 0.344 . . . . 63.41 110.876 -179.957 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -111.8 130.14 55.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.24 -0.436 . . . . 74.21 111.126 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 49.6 m170 -131.24 132.49 44.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.215 -0.448 . . . . 72.53 110.927 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 31.8 m-85 -111.52 138.02 48.59 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.208 -0.451 . . . . 71.44 110.859 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 173' ' ' ASP . . . . . 0.41 ' HB2' ' CE1' ' A' ' 149' ' ' PHE . 65.7 t0 -65.28 96.02 0.21 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.193 -0.458 . . . . 74.11 110.82 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.66 -16.16 9.83 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.234 -0.439 . . . . 74.45 110.911 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -79.01 -16.35 57.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.122 -0.49 . . . . 73.32 110.831 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 23.7 mm-40 -84.61 -171.48 3.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.22 -0.445 . . . . 71.41 110.956 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 177' ' ' ARG . . . . . 0.409 ' HG3' ' HA3' ' A' ' 185' ' ' GLY . 0.0 OUTLIER -115.91 118.66 33.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.156 -0.474 . . . . 74.32 110.854 -179.941 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 45.8 m95 -117.01 144.3 44.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.145 -0.479 . . . . 74.32 110.909 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 12.3 t -178.04 163.65 1.76 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.211 -0.449 . . . . 74.13 111.132 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -125.25 -69.7 0.78 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.274 -0.421 . . . . 61.52 110.885 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -63.2 -13.24 48.27 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.788 -0.72 . . . . 62.41 112.478 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -93.14 -24.31 18.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.939 0.399 . . . . 74.0 110.85 -179.788 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 86.6 p 37.93 43.74 0.55 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 64.12 110.888 -179.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -107.84 -33.54 7.21 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.071 -0.513 . . . . 74.43 110.919 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 185' ' ' GLY . . . . . 0.409 ' HA3' ' HG3' ' A' ' 177' ' ' ARG . . . -112.67 -145.11 9.44 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.711 -0.756 . . . . 74.22 112.525 179.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 186' ' ' ILE . . . . . 0.441 HG13 HD13 ' A' ' 156' ' ' LEU . 11.5 mm -78.87 97.8 2.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.9 0.381 . . . . 73.22 111.121 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 22.1 m-80 -44.55 118.17 1.49 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.216 -0.447 . . . . 71.31 110.884 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 188' ' ' PHE . . . . . 0.554 ' HD2' ' HB3' ' A' ' 108' ' ' LEU . 1.4 t80 -53.96 -36.37 62.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.145 -0.479 . . . . 75.45 110.877 179.998 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.18 -47.16 71.76 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.164 -0.471 . . . . 60.14 110.898 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 6.2 t80 -69.24 -38.93 78.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.186 -0.461 . . . . 74.22 110.92 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -72.01 -35.83 69.53 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.125 -0.489 . . . . 61.32 111.134 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 192' ' ' ALA . . . . . 0.519 ' O ' ' HB2' ' A' ' 196' ' ' LEU . . . -56.98 -45.0 83.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.195 -0.457 . . . . 52.32 111.078 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -58.52 -41.25 85.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.217 -0.447 . . . . 72.43 111.153 -179.919 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 13.7 t-160 -72.77 -45.41 58.72 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.18 -0.464 . . . . 71.44 110.877 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -69.42 -47.41 64.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.206 -0.452 . . . . 71.01 111.095 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 196' ' ' LEU . . . . . 0.519 ' HB2' ' O ' ' A' ' 192' ' ' ALA . 4.0 mm? -66.26 -43.18 87.19 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.244 -0.434 . . . . 74.52 110.903 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -60.67 -24.29 61.94 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.79 -0.719 . . . . 62.43 112.472 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 198' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -68.08 -42.69 80.01 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.807 0.337 . . . . 75.21 110.928 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 199' ' ' SER . . . . . 0.46 ' O ' ' HD3' ' A' ' 162' ' ' PRO . 41.4 t -62.15 -23.3 66.5 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.182 -0.463 . . . . 73.13 110.91 -179.854 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 200' ' ' LEU . . . . . 0.424 HD23 ' CE2' ' A' ' 84' ' ' TRP . 1.6 mt -85.23 2.58 43.25 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.075 -0.511 . . . . 75.12 110.965 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 84.91 -9.37 66.14 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.817 -0.706 . . . . 50.41 112.434 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 202' ' ' MET . . . . . 0.415 ' CE ' ' HB ' ' A' ' 234' ' ' ILE . 0.0 OUTLIER -57.55 130.47 46.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.782 0.325 . . . . 71.04 110.915 179.962 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -101.03 175.12 25.92 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.777 -0.725 . . . . 64.44 112.451 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 17.3 m-70 -68.09 163.47 22.4 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.766 0.317 . . . . 74.32 110.909 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -127.06 156.36 41.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.228 -0.442 . . . . 72.42 110.899 -179.788 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 5.6 p -87.65 -4.28 58.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.208 -0.451 . . . . 72.22 110.817 -179.75 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 -71.29 133.62 85.3 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-O 121.635 0.731 . . . . 65.11 110.811 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 -6.0 17.55 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.682 2.255 . . . . 74.53 112.297 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 -127.64 26.49 5.91 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.252 -0.431 . . . . 63.52 110.841 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 210' ' ' ALA . . . . . 0.409 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.4 145.65 26.21 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.234 -0.439 . . . . 64.4 111.071 179.821 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -67.49 -27.35 38.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.207 -0.451 . . . . 75.23 111.128 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 35.6 mmm -93.83 6.13 49.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.454 . . . . 75.22 110.866 179.881 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 213' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -55.91 111.87 3.66 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.666 0.746 . . . . 73.43 110.955 -179.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.79 -17.79 37.24 Favored 'Trans proline' 0 C--N 1.341 0.135 0 C-N-CA 122.688 2.259 . . . . 63.01 112.32 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.13 60.48 5.93 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.232 -0.44 . . . . 74.24 111.1 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.367 0 CA-C-N 116.191 -0.459 . . . . 74.42 110.914 -179.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.903 0.382 . . . . 71.11 110.864 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.86 158.59 43.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.087 -0.506 . . . . 65.02 110.963 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 226' ' ' LEU . . . . . 0.433 HD13 ' HG2' ' A' ' 119' ' ' GLU . 50.4 mt -69.74 148.92 48.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.231 -0.44 . . . . 62.53 110.908 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 227' ' ' SER . . . . . 0.409 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 0.0 OUTLIER -87.17 148.49 25.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.173 -0.467 . . . . 74.21 110.886 -179.96 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.7 -64.07 0.96 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.158 -0.474 . . . . 74.54 110.919 -179.953 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -55.66 -27.68 51.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.171 -0.468 . . . . 74.2 110.852 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -70.05 -49.36 51.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.157 -0.474 . . . . 74.23 110.857 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 231' ' ' ILE . . . . . . . . . . . . . 8.3 mt -69.39 -44.27 80.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.22 -0.446 . . . . 73.41 111.135 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 1.2 ptmt -56.41 -32.58 64.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.139 -0.482 . . . . 73.32 110.901 179.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -64.95 -50.54 57.5 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.791 -0.719 . . . . 65.45 112.464 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 234' ' ' ILE . . . . . 0.415 ' HB ' ' CE ' ' A' ' 202' ' ' MET . 8.0 tt -73.82 -31.11 30.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.817 0.342 . . . . 74.41 111.16 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -61.67 -23.7 66.25 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.158 -0.474 . . . . 71.13 110.889 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 236' ' ' LYS . . . . . 0.427 ' HD3' ' N ' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.39 -24.61 59.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.252 -0.431 . . . . 74.41 110.884 179.947 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 237' ' ' LEU . . . . . 0.427 ' N ' ' HD3' ' A' ' 236' ' ' LYS . 9.2 tt -93.02 -30.27 15.4 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.252 -0.431 . . . . 75.41 110.918 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 238' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -92.27 -35.4 13.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.167 -0.47 . . . . 54.42 110.921 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.26 0 C-N-CA 120.679 -0.772 . . . . 72.22 112.384 -179.954 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 6.6 t-105 . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.679 0.276 . . . . 71.22 110.889 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -73.32 -36.39 66.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.294 -0.412 . . . . 72.51 110.919 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -63.12 -38.09 89.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.158 -0.474 . . . . 74.32 110.851 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.23 -43.66 94.27 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.207 -0.451 . . . . 74.22 111.062 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -62.2 -43.09 99.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.215 -0.448 . . . . 73.12 110.855 -179.89 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -73.66 -31.52 63.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.208 -0.451 . . . . 72.4 110.888 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -70.74 -36.41 73.13 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.23 -0.441 . . . . 75.11 110.89 -179.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -71.91 -21.04 61.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.149 -0.478 . . . . 75.43 110.973 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 5.1 ptmt -74.85 -34.62 62.31 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.156 -0.475 . . . . 75.45 110.918 179.822 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.04 -27.17 48.71 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.212 -0.449 . . . . 74.22 110.875 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -75.42 2.12 12.24 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.207 -0.451 . . . . 75.2 110.916 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.4 ' O ' ' HB2' ' A' ' 70' ' ' PRO . 7.8 m-85 . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.166 -0.47 . . . . 74.4 110.976 -179.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.43 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.766 0.317 . . . . 74.54 110.895 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.95 -51.05 69.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.244 -0.435 . . . . 73.13 110.944 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.7 -36.79 85.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.175 -0.466 . . . . 71.12 111.096 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.469 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 1.1 tttp -69.5 -49.16 57.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.191 -0.459 . . . . 74.43 110.869 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.43 ' HG ' ' O ' ' A' ' 35' ' ' LEU . 2.1 mt -61.84 -35.62 78.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.251 -0.431 . . . . 74.44 110.909 179.968 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.74 -45.92 88.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.187 -0.461 . . . . 74.2 110.891 179.799 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.469 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 3.5 pt-20 -62.81 -32.43 73.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.26 -0.427 . . . . 75.11 110.841 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.5 ttt -68.05 -34.25 76.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.18 -0.464 . . . . 63.43 110.868 -179.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.408 ' HG2' ' O ' ' A' ' 39' ' ' LEU . 2.6 mm100 -57.26 -39.22 75.19 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.265 -0.425 . . . . 75.32 110.983 -179.961 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.4 mmtt -68.78 -28.76 67.07 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.14 -0.482 . . . . 75.11 110.912 179.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -70.59 -43.84 68.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 73.32 110.881 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -82.05 -34.92 29.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.157 -0.474 . . . . 70.43 110.873 -179.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 102.65 -8.36 54.54 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.785 -0.722 . . . . 64.42 112.575 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.87 136.43 90.29 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.665 0.745 . . . . 74.31 110.874 -179.916 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.69 -51.8 0.37 Allowed 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.715 2.277 . . . . 74.5 112.369 179.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -51.11 108.25 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.219 -0.446 . . . . 72.24 111.102 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 7.4 p -96.24 156.62 16.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.119 -0.492 . . . . 73.25 111.16 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 58.76 20.22 46.57 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.783 -0.722 . . . . 64.24 112.441 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 28.4 mmt -104.99 142.76 34.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.856 0.36 . . . . 75.23 110.805 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.414 ' HA ' ' HB ' ' A' ' 58' ' ' VAL . 32.4 tp -161.9 77.91 0.52 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.194 -0.457 . . . . 74.32 110.925 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -179.04 -29.8 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.198 -0.456 . . . . 61.31 110.869 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 26.7 t -91.45 -98.55 0.12 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.206 -0.452 . . . . 75.25 110.842 -179.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 11.1 tpt180 -84.8 -31.08 24.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.123 -0.49 . . . . 74.13 110.823 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.414 ' HB ' ' HA ' ' A' ' 54' ' ' LEU . 88.9 t -63.94 -43.27 97.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.158 -0.473 . . . . 72.2 111.159 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -69.05 -30.83 47.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.12 -0.491 . . . . 75.2 111.188 179.921 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.52 -43.73 93.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.18 -0.464 . . . . 73.45 110.904 179.936 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -76.18 -29.82 19.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.092 -0.504 . . . . 74.52 111.123 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 10.1 mmm -68.91 -26.64 65.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.454 . . . . 74.01 110.84 179.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -100.07 -24.99 14.45 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.239 -0.437 . . . . 45.15 110.909 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 6.6 mtmp? -85.27 152.6 58.42 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.533 0.682 . . . . 75.32 110.929 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 152.45 69.35 Favored 'Trans proline' 0 N--CA 1.466 -0.138 0 C-N-CA 122.76 2.307 . . . . 72.11 112.303 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 2.1 ttm180 -147.99 -83.69 0.11 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.201 -0.454 . . . . 73.22 110.853 -179.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -145.72 156.57 43.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.184 -0.462 . . . . 72.31 110.882 -179.933 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.551 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -94.98 9.81 70.29 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.704 -0.76 . . . . 64.23 112.51 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -100.33 135.38 20.28 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.574 0.702 . . . . 74.23 111.157 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . 0.4 ' HB2' ' O ' ' A' ' 23' ' ' TYR . 53.1 Cg_endo -69.77 159.81 52.0 Favored 'Trans proline' 0 N--CA 1.465 -0.196 0 C-N-CA 122.709 2.273 . . . . 63.44 112.369 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -94.37 6.66 48.05 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.272 -0.422 . . . . 74.45 110.862 179.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.159 -0.473 . . . . 73.52 111.137 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo . . . . . 0 C--O 1.231 0.16 0 CA-C-O 120.945 0.31 . . . . 72.25 112.363 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 9.7 mtpt -117.17 148.79 41.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.229 -0.441 . . . . 72.53 110.91 179.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . 0.475 ' CE2' HD23 ' A' ' 200' ' ' LEU . 39.2 m0 -47.22 109.49 0.21 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.217 -0.447 . . . . 73.31 110.884 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.0 -5.28 11.97 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.261 -0.427 . . . . 71.34 111.151 -180.0 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -61.83 164.42 6.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 73.12 110.817 -179.844 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 11.5 mmtt -70.91 -30.66 67.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.056 -0.52 . . . . 71.12 110.953 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.421 ' HA ' ' O ' ' A' ' 123' ' ' HIS . 0.3 OUTLIER -154.02 144.92 14.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.258 -0.428 . . . . 74.14 111.092 179.879 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 5.5 t -130.64 137.51 55.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.206 -0.452 . . . . 72.25 111.165 179.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 3.5 p -117.71 167.97 10.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 75.51 111.151 -179.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.436 ' O ' ' CG2' ' A' ' 127' ' ' VAL . 3.7 p90 -150.05 146.58 27.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.251 -0.431 . . . . 70.51 110.93 -179.956 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 5.6 ttt-85 -149.43 139.75 22.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.113 -0.494 . . . . 74.3 110.811 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.8 mm -74.75 134.47 29.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.144 -0.48 . . . . 72.4 111.176 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.482 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 10.7 t -90.03 -40.68 13.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.465 . . . . 74.41 111.137 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 2.5 t -139.63 167.06 22.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.21 -0.45 . . . . 64.24 110.828 -179.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 15.6 p90 -114.93 149.96 36.44 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.115 -0.493 . . . . 74.1 110.945 -179.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' THR . . . . . 0.456 ' O ' ' O ' ' A' ' 100' ' ' LEU . 0.2 OUTLIER -83.22 140.98 32.22 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.114 -0.494 . . . . 75.33 111.113 -179.973 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.33 -8.47 55.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 72.14 110.806 -179.957 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -96.82 -25.61 15.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.252 -0.431 . . . . 74.13 110.818 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.456 ' O ' ' O ' ' A' ' 97' ' ' THR . 0.8 OUTLIER -135.84 153.44 77.18 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.632 0.73 . . . . 72.52 110.9 -179.944 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . 0.42 ' HB2' HG21 ' A' ' 103' ' ' ILE . 53.4 Cg_endo -69.79 151.12 68.81 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.666 2.244 . . . . 73.11 112.361 179.919 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 5.2 t-160 -53.96 -25.72 22.16 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.234 -0.439 . . . . 74.11 110.868 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.42 HG21 ' HB2' ' A' ' 101' ' ' PRO . 15.1 tt -75.57 -38.33 38.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.212 -0.449 . . . . 74.02 111.15 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 3.1 m -69.2 -39.49 78.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.147 -0.479 . . . . 54.24 111.119 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 92.9 t -72.93 -45.41 55.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.214 -0.448 . . . . 73.13 111.143 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.584 ' O ' HG22 ' A' ' 109' ' ' VAL . 49.8 t0 -61.5 -44.55 96.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.13 -0.486 . . . . 63.44 110.92 179.94 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 1.7 ptm180 -69.93 -33.55 72.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.171 -0.468 . . . . 75.02 110.854 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.567 ' HB3' ' HD2' ' A' ' 188' ' ' PHE . 0.0 OUTLIER -60.64 -49.07 79.02 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.15 -0.477 . . . . 75.05 110.954 -179.97 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.584 HG22 ' O ' ' A' ' 106' ' ' ASP . 1.4 m -55.61 -42.2 67.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.199 -0.455 . . . . 72.31 111.132 179.791 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.472 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 34.9 t -70.19 -34.16 72.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.157 -0.474 . . . . 72.14 110.889 -179.854 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.56 -33.36 74.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.091 -0.504 . . . . 74.35 110.842 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -95.09 -40.9 9.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.26 -0.427 . . . . 74.32 111.085 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.65 -33.12 75.16 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.254 -0.43 . . . . 74.11 110.914 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 29.6 t-20 -64.83 -40.95 96.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.177 -0.465 . . . . 75.15 110.861 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.8 -34.62 69.83 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.158 -0.473 . . . . 74.0 110.895 179.953 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 9.1 m95 -66.73 -52.36 45.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.186 -0.461 . . . . 75.23 110.887 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' GLY . . . . . 0.459 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -59.96 -37.39 92.59 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.745 -0.74 . . . . 73.44 112.485 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.4 mmpt? -61.82 -16.86 53.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.777 0.322 . . . . 74.42 110.91 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . 0.454 ' HG2' HG12 ' A' ' 231' ' ' ILE . 0.4 OUTLIER -101.01 13.27 35.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.249 -0.432 . . . . 75.55 110.885 179.96 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . 0.459 ' CG1' ' HA2' ' A' ' 117' ' ' GLY . 2.2 pt -147.16 146.39 25.4 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.641 0.734 . . . . 71.34 111.156 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.72 6.22 1.38 Allowed 'Trans proline' 0 C--O 1.232 0.225 0 C-N-CA 122.809 2.339 . . . . 75.35 112.318 179.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.41 ' HB3' ' H ' ' A' ' 123' ' ' HIS . 4.9 mt -62.52 -156.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.223 -0.444 . . . . 73.22 110.963 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . 0.421 ' O ' ' HA ' ' A' ' 88' ' ' VAL . 3.8 t60 -158.67 127.37 5.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.223 -0.444 . . . . 74.12 110.862 179.851 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 11.5 m-30 -110.49 142.85 41.7 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.191 -0.459 . . . . 75.54 110.907 -179.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.96 140.17 50.12 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.162 -0.472 . . . . 75.14 110.944 -179.968 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.79 142.18 32.83 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.228 -0.442 . . . . 74.04 110.868 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . 0.436 ' CG2' ' O ' ' A' ' 91' ' ' TYR . 30.3 m -103.23 140.33 21.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.189 -0.459 . . . . 50.13 111.131 179.852 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -156.41 -27.54 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.205 -0.452 . . . . 74.43 111.129 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -135.35 109.2 8.1 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.174 -0.467 . . . . 73.32 110.939 179.994 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.97 -158.52 14.83 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.757 -0.735 . . . . 62.11 112.498 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.9 156.29 17.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.8 0.333 . . . . 71.11 111.13 -179.841 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -111.59 165.46 11.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.172 -0.467 . . . . 72.32 111.096 179.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -66.38 -62.58 1.39 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.23 -0.441 . . . . 75.41 110.907 179.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 4.5 mp -82.72 142.55 13.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.112 -0.494 . . . . 71.04 111.148 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 135' ' ' MET . . . . . 0.482 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 27.9 mmt -113.14 119.25 37.18 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.172 -0.467 . . . . 72.43 110.843 179.861 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -105.61 89.91 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.191 -0.459 . . . . 70.04 111.147 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -129.93 167.92 21.5 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.771 -0.728 . . . . 63.34 112.501 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 32.7 m-85 -104.89 149.96 25.26 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.828 0.347 . . . . 74.01 110.848 -179.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . 169.59 165.93 0.05 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.158 -0.473 . . . . 71.21 111.08 179.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 4.6 ptt85 -109.45 174.27 5.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.227 -0.442 . . . . 72.34 110.908 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . 0.407 ' H ' ' HA ' ' A' ' 149' ' ' PHE . . . -55.03 -16.68 8.48 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.695 -0.764 . . . . 74.24 112.528 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -91.45 13.13 18.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.817 0.342 . . . . 75.03 111.115 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 4.1 p80 -80.52 -0.99 39.98 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.199 -0.455 . . . . 73.45 110.911 179.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 107.3 45.15 1.18 Allowed Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.719 -0.753 . . . . 60.43 112.408 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 39.9 p-10 -146.05 168.82 20.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.843 0.354 . . . . 72.14 110.877 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.0 164.96 9.62 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.142 -0.481 . . . . 64.54 110.881 -179.744 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 64.73 132.37 0.03 OUTLIER Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.65 0.738 . . . . 73.4 110.916 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.67 151.02 69.47 Favored 'Trans proline' 0 C--O 1.231 0.125 0 C-N-CA 122.715 2.276 . . . . 74.53 112.342 179.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 149' ' ' PHE . . . . . 0.468 ' C ' ' H ' ' A' ' 151' ' ' GLY . 7.0 p90 -53.94 -41.94 68.28 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.227 -0.442 . . . . 70.0 110.906 179.966 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 76.69 -22.69 0.27 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.118 -0.492 . . . . 72.24 110.861 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . 0.468 ' H ' ' C ' ' A' ' 149' ' ' PHE . . . 74.8 -149.55 39.94 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.812 -0.709 . . . . 75.42 112.472 -179.914 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.71 142.35 47.89 Favored 'Trans proline' 0 C--N 1.341 0.137 0 C-N-CA 122.666 2.244 . . . . 75.11 112.349 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . 0.448 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 104.34 -139.45 14.58 Favored Glycine 0 N--CA 1.453 -0.197 0 C-N-CA 120.669 -0.777 . . . . 70.32 112.456 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 154' ' ' ASN . . . . . 0.448 ' C ' ' O ' ' A' ' 153' ' ' GLY . 4.0 p30 -34.77 140.93 0.07 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.963 0.411 . . . . 74.45 110.895 -179.871 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 155' ' ' THR . . . . . 0.41 ' CB ' ' O ' ' A' ' 154' ' ' ASN . 1.6 m 78.21 107.19 0.07 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.136 -0.484 . . . . 63.14 111.141 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 156' ' ' LEU . . . . . 0.454 HD11 HG13 ' A' ' 186' ' ' ILE . 0.8 OUTLIER -93.8 -54.69 3.52 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.211 -0.449 . . . . 75.02 110.921 179.921 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . 0.551 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -158.56 148.0 19.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.177 -0.465 . . . . 73.44 111.069 179.843 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 26.5 p-80 -109.67 122.47 47.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.21 -0.45 . . . . 74.34 110.824 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -109.59 160.63 16.09 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.221 -0.445 . . . . 74.42 111.13 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 11.8 m-85 -118.4 156.29 29.23 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.208 -0.451 . . . . 75.31 110.865 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -82.85 165.29 42.42 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.543 0.687 . . . . 71.14 111.127 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.89 67.69 1.8 Allowed 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.668 2.246 . . . . 74.44 112.345 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -127.82 107.11 0.84 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.733 -0.746 . . . . 72.32 112.527 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 72.83 174.39 0.29 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.888 0.375 . . . . 73.1 111.119 -179.886 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -50.06 -57.59 9.82 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.776 -0.725 . . . . 74.03 112.433 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -60.48 -18.03 48.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.895 0.378 . . . . 75.02 110.964 -179.937 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -68.87 146.8 45.5 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.766 -0.731 . . . . 43.43 112.55 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 81.33 11.78 82.94 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.751 -0.738 . . . . 74.31 112.487 -179.871 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 57.6 m-20 -79.8 148.83 31.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.848 0.356 . . . . 63.41 110.802 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.26 130.41 55.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.148 -0.478 . . . . 74.21 111.084 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 20.6 m170 -126.86 132.4 50.96 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.218 -0.446 . . . . 72.53 110.911 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 32.2 m-85 -113.7 139.56 48.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.268 -0.424 . . . . 71.44 110.841 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 55.0 t0 -71.63 100.69 2.35 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.129 -0.487 . . . . 74.11 110.809 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.71 -16.73 11.86 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.223 -0.444 . . . . 74.45 110.937 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -77.99 -16.26 58.27 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.104 -0.498 . . . . 73.32 110.911 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -85.05 -174.39 5.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.157 -0.474 . . . . 71.41 110.864 -179.873 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 6.4 mtt85 -112.33 115.14 28.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.156 -0.474 . . . . 74.32 110.85 -179.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 58.9 m95 -115.97 138.5 51.14 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.153 -0.476 . . . . 74.32 110.882 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 7.3 t -176.87 163.57 2.25 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.241 -0.436 . . . . 74.13 111.175 -179.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -125.06 -68.71 0.83 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.277 -0.419 . . . . 61.52 110.84 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -65.14 -11.68 52.59 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.757 -0.735 . . . . 62.41 112.479 -179.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 182' ' ' SER . . . . . 0.429 ' O ' ' C ' ' A' ' 183' ' ' SER . 0.3 OUTLIER -95.38 -24.24 16.8 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.845 0.355 . . . . 74.0 110.84 -179.698 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 183' ' ' SER . . . . . 0.429 ' C ' ' O ' ' A' ' 182' ' ' SER . 89.9 p 34.97 58.87 0.73 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.086 -0.506 . . . . 64.12 110.869 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 2.2 tp -116.73 -33.67 4.74 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.105 -0.498 . . . . 74.43 110.887 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -119.58 -138.41 5.71 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.754 -0.736 . . . . 74.22 112.489 179.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 186' ' ' ILE . . . . . 0.454 HG13 HD11 ' A' ' 156' ' ' LEU . 6.1 mm -79.51 98.75 3.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.897 0.379 . . . . 73.22 111.142 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -46.65 127.25 9.37 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.132 -0.486 . . . . 71.31 110.886 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 188' ' ' PHE . . . . . 0.567 ' HD2' ' HB3' ' A' ' 108' ' ' LEU . 1.2 t80 -60.66 -37.39 81.42 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.217 -0.447 . . . . 75.45 110.93 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.7 -47.89 70.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.129 -0.487 . . . . 60.14 110.933 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 48.8 t80 -69.7 -38.57 77.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.464 . . . . 74.22 110.948 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -72.88 -35.91 67.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.085 -0.507 . . . . 61.32 111.068 179.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 192' ' ' ALA . . . . . 0.491 ' O ' ' HB2' ' A' ' 196' ' ' LEU . . . -57.26 -45.23 84.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.194 -0.457 . . . . 52.32 111.057 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.39 -41.94 86.0 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.159 -0.473 . . . . 72.43 111.167 -179.883 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 4.9 t60 -72.71 -45.56 58.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.199 -0.455 . . . . 71.44 110.853 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -68.02 -47.96 67.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.202 -0.454 . . . . 71.01 111.079 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 196' ' ' LEU . . . . . 0.502 ' N ' HD23 ' A' ' 196' ' ' LEU . 4.4 mm? -63.71 -37.32 86.92 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.199 -0.455 . . . . 74.52 110.954 -179.929 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -61.97 -26.46 67.33 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.783 -0.723 . . . . 62.43 112.541 179.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 198' ' ' HIS . . . . . . . . . . . . . 6.1 m-70 -68.83 -42.87 76.61 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.753 0.311 . . . . 75.21 110.84 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.18 -27.59 65.82 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.452 . . . . 73.13 110.888 -179.765 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 200' ' ' LEU . . . . . 0.475 HD23 ' CE2' ' A' ' 84' ' ' TRP . 0.6 OUTLIER -84.78 0.17 51.66 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.041 -0.527 . . . . 75.12 110.938 179.973 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 88.36 -9.37 75.65 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.697 -0.764 . . . . 50.41 112.444 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 202' ' ' MET . . . . . 0.461 ' CE ' ' HB ' ' A' ' 234' ' ' ILE . 0.4 OUTLIER -60.33 127.14 30.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.838 0.352 . . . . 71.04 110.886 -179.995 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -101.03 178.86 28.44 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.781 -0.724 . . . . 64.44 112.486 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 18.4 m-70 -68.94 159.65 32.29 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.821 0.343 . . . . 74.32 110.86 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -122.25 157.36 31.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.204 -0.453 . . . . 72.42 110.807 -179.764 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -87.88 -4.43 58.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.084 -0.507 . . . . 72.22 110.863 -179.827 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.44 137.49 83.68 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.681 0.753 . . . . 65.11 110.871 179.943 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 -6.68 19.17 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.694 2.263 . . . . 74.53 112.348 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 -127.61 33.48 4.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.213 -0.449 . . . . 63.52 110.896 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 210' ' ' ALA . . . . . 0.496 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.14 145.99 26.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.156 -0.475 . . . . 64.4 111.104 179.851 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -73.47 -26.86 22.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.213 -0.449 . . . . 75.23 111.2 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 16.3 tpp -94.76 6.94 47.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.14 -0.482 . . . . 75.22 110.846 179.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 213' ' ' TYR . . . . . 0.408 ' HB2' ' O ' ' A' ' 210' ' ' ALA . 0.1 OUTLIER -56.2 127.32 70.21 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.703 0.763 . . . . 73.43 110.929 -179.857 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.77 -29.57 23.63 Favored 'Trans proline' 0 C--O 1.231 0.159 0 C-N-CA 122.687 2.258 . . . . 63.01 112.357 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 60.4 p -84.42 62.23 7.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.214 -0.448 . . . . 74.24 111.205 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.247 -0.433 . . . . 74.42 110.906 -179.909 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.863 0.363 . . . . 71.11 110.901 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -143.6 159.24 42.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.153 -0.476 . . . . 65.02 110.964 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 226' ' ' LEU . . . . . 0.4 HD13 ' HG2' ' A' ' 119' ' ' GLU . 29.9 mt -65.5 148.79 51.14 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.286 -0.415 . . . . 62.53 110.924 179.93 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 227' ' ' SER . . . . . 0.496 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 1.8 t -87.65 151.71 22.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.216 -0.447 . . . . 74.21 110.83 -179.922 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.54 -63.0 1.15 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.115 -0.493 . . . . 74.54 110.89 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -55.7 -27.47 50.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.163 -0.471 . . . . 74.2 110.842 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -70.58 -49.41 48.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.279 -0.418 . . . . 74.23 110.885 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 231' ' ' ILE . . . . . 0.454 HG12 ' HG2' ' A' ' 119' ' ' GLU . 9.5 mt -69.34 -45.03 79.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 73.41 111.101 179.972 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.21 -33.18 67.25 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.238 -0.437 . . . . 73.32 110.867 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -63.12 -49.49 71.09 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.81 -0.709 . . . . 65.45 112.467 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 234' ' ' ILE . . . . . 0.461 ' HB ' ' CE ' ' A' ' 202' ' ' MET . 6.8 tt -72.59 -29.1 29.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.814 0.34 . . . . 74.41 111.16 180.0 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -60.23 -28.51 68.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.159 -0.473 . . . . 71.13 110.944 179.945 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 236' ' ' LYS . . . . . 0.452 ' HD3' ' N ' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.67 -27.3 60.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.241 -0.436 . . . . 74.41 110.92 179.915 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 237' ' ' LEU . . . . . 0.452 ' N ' ' HD3' ' A' ' 236' ' ' LYS . 8.2 tt -97.48 -24.59 15.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.213 -0.449 . . . . 75.41 110.936 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 238' ' ' TYR . . . . . 0.44 ' CD1' HG13 ' A' ' 234' ' ' ILE . 3.8 m-85 -92.31 -35.38 13.78 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.452 . . . . 54.42 110.925 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.328 0 C-N-CA 120.763 -0.732 . . . . 72.22 112.475 179.993 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 15.2 t-105 . . . . . 0 C--O 1.23 0.029 0 CA-C-O 120.742 0.306 . . . . 71.22 110.958 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -73.27 -35.26 66.15 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.236 -0.438 . . . . 72.51 110.825 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.98 -39.26 94.18 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.205 -0.452 . . . . 74.32 110.864 -179.876 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.22 -35.13 69.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.174 -0.466 . . . . 74.22 111.069 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.31 -40.07 85.97 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.251 -0.431 . . . . 73.12 110.896 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -77.18 -31.71 55.61 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.191 -0.459 . . . . 72.4 110.873 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -62.73 -36.16 82.09 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.185 -0.461 . . . . 75.11 110.926 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -71.38 -21.04 62.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.124 -0.489 . . . . 75.43 110.896 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 4.4 ptmt -74.8 -29.81 61.22 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.206 -0.452 . . . . 75.45 110.928 179.829 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.6 ptp85 -86.59 -28.03 23.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.205 -0.452 . . . . 74.22 110.905 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 13.0 m-85 -68.82 -10.66 58.05 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.157 -0.474 . . . . 75.2 110.814 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 . . . . . 0 C--N 1.328 -0.362 0 CA-C-N 116.197 -0.456 . . . . 74.4 110.92 -179.852 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.3 tt . . . . . 0 N--CA 1.458 -0.066 0 CA-C-O 120.837 0.351 . . . . 74.54 110.982 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.09 -51.22 65.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.184 -0.462 . . . . 73.13 110.872 179.935 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.5 -51.04 68.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.076 -0.511 . . . . 71.12 111.138 179.898 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.481 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 5.9 tttp -59.94 -49.35 78.03 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.222 -0.445 . . . . 74.43 110.891 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.421 ' O ' ' HG2' ' A' ' 43' ' ' GLN . 0.1 OUTLIER -58.04 -36.4 72.69 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.261 -0.427 . . . . 74.44 110.909 179.922 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.2 tttm -58.99 -45.7 90.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.151 -0.477 . . . . 74.2 110.847 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.481 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 3.2 pt-20 -60.58 -32.62 71.72 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.226 -0.443 . . . . 75.11 110.905 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 7.5 ttt -68.37 -33.99 75.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.197 -0.456 . . . . 63.43 110.892 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.425 ' HG3' ' HA ' ' A' ' 51' ' ' THR . 1.3 mm-40 -61.33 -39.66 91.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.242 -0.435 . . . . 75.32 110.964 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.2 mmpt? -72.39 -32.97 66.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 75.11 110.862 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 56.3 t80 -70.63 -40.68 72.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.181 -0.463 . . . . 73.32 110.839 180.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -82.25 -35.16 28.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.185 -0.462 . . . . 70.43 110.819 -179.829 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 104.05 -10.17 51.34 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.784 -0.722 . . . . 64.42 112.489 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.11 138.13 91.24 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.518 0.675 . . . . 74.31 110.936 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 -53.55 0.26 Allowed 'Trans proline' 0 C--O 1.231 0.151 0 C-N-CA 122.713 2.276 . . . . 74.5 112.35 179.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -51.9 108.25 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 72.24 111.196 179.934 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.425 ' HA ' ' HG3' ' A' ' 43' ' ' GLN . 39.8 p -113.96 151.5 32.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.155 -0.475 . . . . 73.25 111.149 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 76.46 -0.61 63.84 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.756 -0.735 . . . . 64.24 112.528 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.9 mtt -135.22 161.08 36.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.836 0.35 . . . . 75.23 110.892 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.414 ' HA ' ' HB ' ' A' ' 58' ' ' VAL . 2.8 pp -156.78 128.63 7.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.271 -0.422 . . . . 74.32 110.882 -179.945 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.4 t30 173.01 -28.67 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.165 -0.471 . . . . 61.31 110.836 179.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 23.1 p -96.85 -87.09 0.32 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.216 -0.447 . . . . 75.25 110.856 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -84.49 -34.77 23.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.187 -0.46 . . . . 74.13 110.864 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.512 ' O ' HG13 ' A' ' 61' ' ' ILE . 14.1 t -59.94 -46.92 93.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.224 -0.444 . . . . 72.2 111.143 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.0 tp -75.61 -32.14 24.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.165 -0.471 . . . . 75.2 111.099 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -59.92 -44.24 94.42 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.208 -0.451 . . . . 73.45 110.884 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.512 HG13 ' O ' ' A' ' 58' ' ' VAL . 1.7 pp -67.94 -29.52 45.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.225 -0.443 . . . . 74.52 111.098 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 4.7 mmt -61.68 -39.16 90.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.192 -0.458 . . . . 74.01 110.806 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -90.26 -26.29 20.13 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.275 -0.421 . . . . 45.15 110.935 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 4.1 mtmp? -85.21 133.95 41.73 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.573 0.701 . . . . 75.32 110.864 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.7 149.85 67.83 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.69 2.26 . . . . 72.11 112.368 179.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.31 -78.63 0.2 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.198 -0.455 . . . . 73.22 110.875 -179.934 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 16.0 p -145.29 141.51 28.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.186 -0.461 . . . . 72.31 110.852 -179.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.573 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -90.32 17.2 55.16 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.768 -0.729 . . . . 64.23 112.518 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -110.52 141.19 23.48 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.556 0.693 . . . . 74.23 111.154 -179.955 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 -179.86 3.2 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.615 2.21 . . . . 63.44 112.367 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -139.33 27.33 2.32 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.211 -0.449 . . . . 74.45 110.902 179.917 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 116.207 -0.451 . . . . 73.52 111.128 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo . . . . . 0 C--O 1.232 0.213 0 CA-C-O 120.831 0.263 . . . . 72.25 112.362 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.07 -178.47 5.47 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.237 -0.438 . . . . 72.53 110.898 179.865 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . 0.506 ' CE2' HD21 ' A' ' 200' ' ' LEU . 38.1 m0 -59.11 109.77 0.92 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 73.31 110.958 179.926 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 12.0 t -104.49 -14.87 15.53 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.289 -0.414 . . . . 71.34 111.092 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -56.76 152.45 12.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.261 -0.427 . . . . 73.12 110.87 -179.867 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.95 -30.58 71.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.163 -0.471 . . . . 71.12 110.875 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -156.94 144.12 10.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.28 -0.418 . . . . 74.14 111.122 179.86 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 64.7 t -124.36 138.99 52.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.192 -0.458 . . . . 72.25 111.131 179.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 1.1 p -115.83 151.14 35.81 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.159 -0.473 . . . . 75.51 111.127 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 5.4 p90 -133.11 146.55 51.71 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.218 -0.447 . . . . 70.51 110.939 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -148.29 138.17 22.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.102 -0.499 . . . . 74.3 110.832 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 11.7 mm -77.59 135.18 26.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.167 -0.47 . . . . 72.4 111.141 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.431 ' HB ' ' HA3' ' A' ' 137' ' ' GLY . 15.3 t -91.37 -40.5 12.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.173 -0.467 . . . . 74.41 111.14 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 3.8 t -141.44 169.44 17.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.145 -0.479 . . . . 64.24 110.859 -179.755 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 12.2 p90 -117.27 150.34 38.95 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.177 -0.465 . . . . 74.1 110.94 -179.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' THR . . . . . 0.454 ' O ' ' O ' ' A' ' 100' ' ' LEU . 0.2 OUTLIER -82.87 141.06 32.53 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.145 -0.48 . . . . 75.33 111.17 -179.986 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 2.0 ptt180 -72.42 -8.07 53.09 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.207 -0.451 . . . . 72.14 110.852 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -96.63 -25.94 15.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.218 -0.446 . . . . 74.13 110.801 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.454 ' O ' ' O ' ' A' ' 97' ' ' THR . 0.7 OUTLIER -135.54 152.67 76.78 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.675 0.75 . . . . 72.52 110.902 -179.974 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . 0.418 ' HB2' HG22 ' A' ' 103' ' ' ILE . 54.1 Cg_endo -69.69 151.04 69.41 Favored 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.706 2.271 . . . . 73.11 112.336 179.915 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 6.0 t-160 -52.91 -25.71 12.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.191 -0.459 . . . . 74.11 110.884 179.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.418 HG22 ' HB2' ' A' ' 101' ' ' PRO . 13.9 tt -76.74 -39.14 31.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.223 -0.444 . . . . 74.02 111.153 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 3.4 m -69.07 -40.06 78.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 54.24 111.179 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 90.7 t -72.99 -45.35 55.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.213 -0.449 . . . . 73.13 111.137 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.56 ' O ' HG22 ' A' ' 109' ' ' VAL . 48.1 t0 -61.3 -45.11 95.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.164 -0.471 . . . . 63.44 110.835 179.873 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 4.7 ptm85 -69.71 -33.31 72.32 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.196 -0.457 . . . . 75.02 110.902 -179.873 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.526 ' HB3' ' HD2' ' A' ' 188' ' ' PHE . 0.0 OUTLIER -60.38 -48.72 80.53 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.241 -0.436 . . . . 75.05 110.911 179.957 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.56 HG22 ' O ' ' A' ' 106' ' ' ASP . 1.2 m -55.44 -41.89 64.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.173 -0.467 . . . . 72.31 111.104 179.824 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.471 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 47.2 t -70.0 -34.35 73.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.204 -0.453 . . . . 72.14 110.838 -179.787 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.51 -33.4 74.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.186 -0.461 . . . . 74.35 110.906 179.939 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -93.27 -40.61 10.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.206 -0.452 . . . . 74.32 111.061 179.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.85 -33.35 75.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.232 -0.44 . . . . 74.11 110.928 -179.937 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -67.31 -40.99 86.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.233 -0.44 . . . . 75.15 110.882 179.88 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' MET . . . . . 0.427 ' HA ' ' HE3' ' A' ' 118' ' ' LYS . 0.0 OUTLIER -57.93 -34.35 69.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.184 -0.462 . . . . 74.0 110.921 179.89 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' TRP . . . . . 0.456 ' O ' HG12 ' A' ' 120' ' ' ILE . 6.5 m95 -64.84 -49.6 69.95 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.172 -0.467 . . . . 75.23 110.938 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' GLY . . . . . 0.601 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -73.02 -24.92 74.96 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.801 -0.714 . . . . 73.44 112.468 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . 0.427 ' HE3' ' HA ' ' A' ' 115' ' ' MET . 0.3 OUTLIER -64.52 -13.95 54.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.736 0.303 . . . . 74.42 110.921 -179.985 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . 0.449 ' HG3' HG12 ' A' ' 231' ' ' ILE . 1.7 mm-40 -112.61 13.91 20.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.181 -0.463 . . . . 75.55 110.953 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . 0.601 ' CG1' ' HA2' ' A' ' 117' ' ' GLY . 5.0 pt -148.25 150.08 33.78 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.679 0.752 . . . . 71.34 111.161 179.975 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 24.51 0.18 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.658 2.239 . . . . 75.35 112.377 179.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.529 ' H ' ' C ' ' A' ' 120' ' ' ILE . 8.3 mt -70.95 -155.03 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.107 -0.497 . . . . 73.22 110.92 179.938 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . 0.463 ' H ' ' HB3' ' A' ' 122' ' ' LEU . 3.5 t-160 -172.53 121.51 0.42 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.136 -0.484 . . . . 74.12 110.871 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.9 m-85 -106.97 141.79 37.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.261 -0.427 . . . . 75.54 110.876 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.24 141.17 48.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.191 -0.459 . . . . 75.14 110.897 -179.931 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.88 140.09 35.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.153 -0.476 . . . . 74.04 110.864 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 32.7 m -103.06 138.29 27.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.205 -0.452 . . . . 50.13 111.132 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -153.47 -27.66 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.166 -0.47 . . . . 74.43 111.107 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -134.5 109.26 8.6 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.1 -0.5 . . . . 73.32 110.932 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.39 -160.5 14.05 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.737 -0.744 . . . . 62.11 112.538 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -101.83 155.64 18.01 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.829 0.347 . . . . 71.11 111.165 -179.883 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -112.22 165.28 12.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.216 -0.447 . . . . 72.32 111.061 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -73.11 -57.03 4.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 75.41 110.834 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 7.0 mm -82.5 112.79 20.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.189 -0.459 . . . . 71.04 111.102 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 2.0 mmm -96.63 116.6 29.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.115 -0.493 . . . . 72.43 110.903 179.86 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -106.21 94.64 3.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.238 -0.437 . . . . 70.04 111.096 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . 0.431 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -134.31 169.46 23.02 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.748 -0.739 . . . . 63.34 112.514 179.856 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -105.13 149.83 25.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.847 0.356 . . . . 74.01 110.844 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . 171.36 167.71 0.08 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.071 -0.513 . . . . 71.21 111.04 179.899 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . 0.431 ' HB3' ' HB3' ' A' ' 149' ' ' PHE . 35.1 mtp180 -103.95 173.04 6.47 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.188 -0.46 . . . . 72.34 110.855 -179.883 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -57.34 -16.23 19.74 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.682 -0.77 . . . . 74.24 112.553 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -94.52 13.34 24.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.804 0.335 . . . . 75.03 111.075 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 9.2 p80 -71.49 -9.35 58.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 73.45 110.854 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 116.9 50.03 0.41 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.739 -0.743 . . . . 60.43 112.458 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -162.56 170.7 18.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.851 0.358 . . . . 72.14 110.851 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -64.11 175.86 1.15 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.129 -0.487 . . . . 64.54 110.836 -179.719 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 11.2 m-85 64.37 119.36 0.02 OUTLIER Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.634 0.731 . . . . 73.4 110.95 -179.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.69 151.76 69.55 Favored 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.702 2.268 . . . . 74.53 112.327 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 149' ' ' PHE . . . . . 0.476 ' C ' ' H ' ' A' ' 151' ' ' GLY . 8.2 p90 -53.44 -42.7 67.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 70.0 110.867 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 75.55 -22.03 0.28 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.187 -0.46 . . . . 72.24 110.888 179.994 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . 0.476 ' H ' ' C ' ' A' ' 149' ' ' PHE . . . 75.64 -156.11 47.63 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.766 -0.731 . . . . 75.42 112.486 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -69.7 142.45 48.22 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.717 2.278 . . . . 75.11 112.362 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . 0.443 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 104.52 -137.27 13.52 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.719 -0.753 . . . . 70.32 112.466 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 154' ' ' ASN . . . . . 0.443 ' C ' ' O ' ' A' ' 153' ' ' GLY . 9.7 p30 -35.03 144.38 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.981 0.419 . . . . 74.45 110.919 -179.923 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 73.49 106.75 0.07 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.178 -0.465 . . . . 63.14 111.119 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 156' ' ' LEU . . . . . 0.451 HD12 HG13 ' A' ' 186' ' ' ILE . 0.6 OUTLIER -87.87 -55.16 3.88 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.2 -0.455 . . . . 75.02 110.873 179.962 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . 0.573 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -163.68 148.24 10.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.203 -0.453 . . . . 73.44 111.162 179.764 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 23.8 p-80 -107.01 128.95 54.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.234 -0.439 . . . . 74.34 110.912 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -109.84 160.33 16.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.195 -0.457 . . . . 74.42 111.078 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 10.7 m-30 -106.59 141.66 37.52 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.231 -0.441 . . . . 75.31 110.919 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -73.85 163.48 68.08 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.57 0.7 . . . . 71.14 111.064 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -69.82 76.15 1.19 Allowed 'Trans proline' 0 C--N 1.341 0.136 0 C-N-CA 122.704 2.269 . . . . 74.44 112.31 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -127.46 100.6 0.55 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.725 -0.75 . . . . 72.32 112.445 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 1.3 p 60.21 176.83 0.09 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.856 0.36 . . . . 73.1 111.144 -179.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -52.29 -47.94 54.86 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.733 -0.746 . . . . 74.03 112.439 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.17 -19.67 55.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.884 0.373 . . . . 75.02 110.925 -179.893 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -84.71 168.88 44.15 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.768 -0.729 . . . . 43.43 112.482 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 74.6 16.79 80.0 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.711 -0.757 . . . . 74.31 112.453 -179.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -77.33 150.2 35.21 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.818 0.342 . . . . 63.41 110.896 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.67 129.97 56.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.215 -0.448 . . . . 74.21 111.079 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 28.6 m170 -131.3 132.32 44.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.229 -0.442 . . . . 72.53 110.883 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 51.4 m-85 -117.72 139.38 51.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.166 -0.47 . . . . 71.44 110.903 -179.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 59.0 t0 -71.35 98.86 1.85 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.164 -0.471 . . . . 74.11 110.88 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 1.7 pp20? -57.7 -16.33 10.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.225 -0.443 . . . . 74.45 110.859 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -78.95 -16.35 57.07 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.161 -0.472 . . . . 73.32 110.84 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 -82.11 -176.06 5.96 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.259 -0.428 . . . . 71.41 110.973 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 177' ' ' ARG . . . . . 0.401 ' HG3' ' HA3' ' A' ' 185' ' ' GLY . 4.3 ptp180 -116.82 111.86 20.31 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.219 -0.446 . . . . 74.32 110.944 -179.989 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 5.1 m95 -117.29 152.27 35.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.172 -0.467 . . . . 74.32 110.944 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 7.8 t 178.41 163.7 0.73 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.27 -0.423 . . . . 74.13 111.142 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -120.55 -75.09 0.59 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.21 -0.45 . . . . 61.52 110.892 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -56.13 -20.18 26.91 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.721 -0.752 . . . . 62.41 112.486 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 182' ' ' SER . . . . . 0.447 ' O ' ' C ' ' A' ' 183' ' ' SER . 0.4 OUTLIER -90.9 -24.7 20.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.963 0.411 . . . . 74.0 110.935 -179.802 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 183' ' ' SER . . . . . 0.447 ' C ' ' O ' ' A' ' 182' ' ' SER . 12.9 p 34.45 47.96 0.25 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.06 -0.518 . . . . 64.12 110.873 -179.806 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 3.6 tp -105.42 -33.71 8.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.102 -0.499 . . . . 74.43 110.981 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 185' ' ' GLY . . . . . 0.401 ' HA3' ' HG3' ' A' ' 177' ' ' ARG . . . -114.39 -141.82 7.79 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.763 -0.732 . . . . 74.22 112.504 179.922 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 186' ' ' ILE . . . . . 0.451 HG13 HD12 ' A' ' 156' ' ' LEU . 10.5 mm -78.82 97.58 2.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.888 0.375 . . . . 73.22 111.134 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -46.57 119.5 2.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.168 -0.469 . . . . 71.31 110.838 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 188' ' ' PHE . . . . . 0.526 ' HD2' ' HB3' ' A' ' 108' ' ' LEU . 2.4 t80 -54.19 -36.46 63.45 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.474 . . . . 75.45 110.898 179.975 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . 0.404 HD23 HD11 ' A' ' 108' ' ' LEU . 0.0 OUTLIER -67.11 -47.47 71.04 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.137 -0.483 . . . . 60.14 110.925 -179.965 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 58.3 t80 -69.07 -37.04 78.29 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.201 -0.454 . . . . 74.22 110.973 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -72.81 -35.57 67.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.085 -0.507 . . . . 61.32 111.126 179.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 192' ' ' ALA . . . . . 0.445 ' O ' ' HB2' ' A' ' 196' ' ' LEU . . . -56.73 -44.84 82.06 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.217 -0.447 . . . . 52.32 111.131 179.847 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -58.65 -41.89 87.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.168 -0.469 . . . . 72.43 111.161 -179.892 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 2.6 t60 -72.83 -40.61 65.61 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.236 -0.438 . . . . 71.44 110.8 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -73.42 -47.44 41.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.181 -0.463 . . . . 71.01 111.061 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 196' ' ' LEU . . . . . 0.495 HD22 ' N ' ' A' ' 196' ' ' LEU . 4.4 mm? -64.2 -43.42 95.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.211 -0.45 . . . . 74.52 110.942 -179.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -57.44 -28.2 59.12 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.706 -0.759 . . . . 62.43 112.473 179.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 198' ' ' HIS . . . . . . . . . . . . . 4.7 m-70 -66.5 -44.26 83.07 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.827 0.346 . . . . 75.21 110.871 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.42 -25.86 64.69 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.207 -0.451 . . . . 73.13 110.891 -179.824 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 200' ' ' LEU . . . . . 0.506 HD21 ' CE2' ' A' ' 84' ' ' TRP . 1.5 mt -82.22 -3.07 54.33 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.161 -0.472 . . . . 75.12 110.879 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 88.96 -5.64 84.36 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.807 -0.711 . . . . 50.41 112.565 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 202' ' ' MET . . . . . 0.425 ' SD ' ' CZ3' ' A' ' 116' ' ' TRP . 2.2 mtp -61.93 134.97 57.34 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.815 0.34 . . . . 71.04 110.907 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -101.17 177.11 27.32 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.787 -0.721 . . . . 64.44 112.494 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 17.9 m-70 -70.26 160.76 31.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.782 0.325 . . . . 74.32 110.868 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -121.39 151.72 39.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.194 -0.457 . . . . 72.42 110.827 -179.768 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 2.0 p -87.73 -4.63 58.89 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.178 -0.465 . . . . 72.22 110.818 -179.834 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.83 137.9 82.63 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.646 0.736 . . . . 65.11 110.791 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 -7.61 21.49 Favored 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.641 2.227 . . . . 74.53 112.311 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -126.08 29.79 5.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.26 -0.427 . . . . 63.52 110.862 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 210' ' ' ALA . . . . . 0.449 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.34 145.76 26.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.123 -0.489 . . . . 64.4 111.112 179.878 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -69.69 -28.57 37.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.185 -0.461 . . . . 75.23 111.08 -179.929 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 14.0 tpp -96.48 10.49 38.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.177 -0.465 . . . . 75.22 110.953 179.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 213' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -55.69 115.05 8.5 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.629 0.728 . . . . 73.43 110.862 -179.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.78 -18.11 37.12 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.661 2.24 . . . . 63.01 112.353 179.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -84.2 52.95 2.46 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.254 -0.43 . . . . 74.24 111.165 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 5.8 t80 . . . . . 0 C--N 1.328 -0.355 0 CA-C-N 116.163 -0.471 . . . . 74.42 110.912 -179.861 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.988 0.423 . . . . 71.11 110.895 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -143.76 161.0 39.73 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.166 -0.47 . . . . 65.02 110.907 179.941 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 36.3 mt -64.38 147.99 51.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.272 -0.422 . . . . 62.53 110.849 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 227' ' ' SER . . . . . 0.449 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 0.9 OUTLIER -87.73 150.86 23.34 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.106 -0.497 . . . . 74.21 110.832 -179.924 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 -65.08 -66.8 0.5 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.18 -0.464 . . . . 74.54 110.922 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -55.37 -26.02 38.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.208 -0.451 . . . . 74.2 110.902 179.932 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -70.37 -49.04 53.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.156 -0.474 . . . . 74.23 110.868 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 231' ' ' ILE . . . . . 0.449 HG12 ' HG3' ' A' ' 119' ' ' GLU . 9.4 mt -69.4 -44.18 80.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.263 -0.426 . . . . 73.41 111.12 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.8 -31.98 65.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.142 -0.481 . . . . 73.32 110.932 179.86 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -70.13 -46.05 52.91 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.72 -0.753 . . . . 65.45 112.48 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 15.1 tt -73.18 -32.94 40.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.784 0.326 . . . . 74.41 111.114 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -66.33 -24.35 66.51 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.147 -0.479 . . . . 71.13 110.954 179.904 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 236' ' ' LYS . . . . . 0.468 ' HD3' ' N ' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.04 -28.97 61.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.172 -0.467 . . . . 74.41 110.829 -179.983 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 237' ' ' LEU . . . . . 0.468 ' N ' ' HD3' ' A' ' 236' ' ' LYS . 5.7 tt -97.09 -23.61 16.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.251 -0.431 . . . . 75.41 110.925 179.952 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 238' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -92.45 -35.53 13.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.17 -0.468 . . . . 54.42 110.927 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.264 0 C-N-CA 120.724 -0.75 . . . . 72.22 112.451 179.977 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' -2' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.107 0 CA-C-O 121.572 0.701 . . . . 73.02 110.964 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -1' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 167.73 23.61 Favored 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 122.704 2.269 . . . . 73.21 112.327 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -174.88 73.6 0.3 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.67 0.747 . . . . 75.23 110.936 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 -171.34 0.46 Allowed 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.67 2.247 . . . . 64.24 112.316 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -153.13 77.0 1.14 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.179 -0.464 . . . . 62.24 110.935 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -95.3 -24.37 16.79 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.147 -0.478 . . . . 74.01 110.864 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.45 -33.96 66.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 71.4 111.143 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -55.87 -32.63 59.29 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.709 -0.758 . . . . 62.21 112.501 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -108.84 21.58 27.37 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.764 -0.731 . . . . 54.42 112.496 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.33 164.28 25.68 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.774 0.321 . . . . 72.23 110.855 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 47.9 t -87.03 168.73 13.05 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.221 -0.445 . . . . 73.24 110.857 -179.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.41 -31.94 71.87 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.136 -0.484 . . . . 73.44 110.848 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.38 -42.84 98.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.167 -0.469 . . . . 72.33 110.973 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.8 -40.73 95.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.146 -0.479 . . . . 72.14 110.939 179.887 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 21.1 t-105 -73.06 -35.42 66.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.187 -0.46 . . . . 71.22 110.898 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 49.7 tt0 -73.3 -35.46 66.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.267 -0.424 . . . . 72.51 110.852 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 13.3 mt-30 -62.92 -36.83 84.67 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.206 -0.452 . . . . 74.32 110.903 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.1 -35.16 69.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.202 -0.454 . . . . 74.22 111.117 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.78 -42.91 94.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.149 -0.478 . . . . 73.12 110.912 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -76.99 -31.48 56.53 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.19 -0.459 . . . . 72.4 110.87 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -60.33 -44.08 95.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.159 -0.473 . . . . 75.11 110.907 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -71.43 -22.27 61.87 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.138 -0.483 . . . . 75.43 110.862 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.441 ' HE2' ' HA ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -72.3 -43.75 63.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.2 -0.455 . . . . 75.45 110.919 179.816 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.441 ' HA ' ' HE2' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -70.25 -27.84 64.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.445 . . . . 74.22 110.853 179.999 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -74.09 -5.72 43.33 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.21 -0.45 . . . . 75.2 110.852 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -120.75 -79.11 0.6 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.163 -0.471 . . . . 74.4 110.943 -179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 18.7 mt -159.28 -176.81 6.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.133 -0.485 . . . . 75.43 110.882 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -94.48 89.65 5.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.173 -0.467 . . . . 71.41 110.92 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 56.8 m-20 -125.06 96.07 4.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.147 -0.479 . . . . 74.25 110.912 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.6 p -85.08 -6.44 59.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.213 -0.449 . . . . 62.15 110.858 -179.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -82.51 -21.65 35.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.144 -0.48 . . . . 74.51 110.88 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 4.9 m -76.9 -4.8 45.66 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.156 -0.475 . . . . 72.53 111.115 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 58.5 mttt -58.06 100.33 0.06 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.179 -0.464 . . . . 74.12 110.883 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -168.45 160.65 11.3 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.19 -0.459 . . . . 74.52 110.862 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.11 -39.69 60.41 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.147 -0.479 . . . . 71.02 111.121 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 -72.72 -40.27 66.28 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.191 -0.459 . . . . 71.33 110.858 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 59.7 m -59.53 -21.35 60.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 74.02 110.89 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.3 tt -63.74 -44.37 93.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.148 -0.478 . . . . 74.54 110.913 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.93 -51.12 65.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.136 -0.484 . . . . 73.13 110.857 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.31 -50.48 69.9 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.177 -0.465 . . . . 71.12 111.097 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.462 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 24.4 mmmt -59.95 -49.51 77.39 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.226 -0.443 . . . . 74.43 110.896 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.412 ' O ' ' HG2' ' A' ' 43' ' ' GLN . 0.1 OUTLIER -56.67 -36.99 70.21 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.266 -0.425 . . . . 74.44 110.894 179.917 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.5 ttmt -58.99 -45.5 90.48 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.451 . . . . 74.2 110.856 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.462 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 2.9 pt-20 -60.58 -32.84 71.92 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.247 -0.433 . . . . 75.11 110.827 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 7.2 ttt -68.47 -34.0 75.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.171 -0.468 . . . . 63.43 110.876 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.466 ' HG3' ' HA ' ' A' ' 51' ' ' THR . 2.3 mm100 -60.65 -39.98 90.33 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.215 -0.448 . . . . 75.32 110.916 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.2 mmpt? -70.58 -33.13 70.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 75.11 110.9 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 38.4 t80 -70.77 -37.33 73.36 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.232 -0.44 . . . . 73.32 110.903 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -81.91 -35.63 28.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.108 -0.496 . . . . 70.43 110.869 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.423 ' HA2' ' HB3' ' A' ' 206' ' ' SER . . . 102.98 -10.2 55.41 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.742 -0.742 . . . . 64.42 112.51 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.84 139.76 95.55 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.644 0.735 . . . . 74.31 110.898 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.77 -53.23 0.28 Allowed 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.68 2.253 . . . . 74.5 112.318 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -50.64 108.27 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.209 -0.451 . . . . 72.24 111.129 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.466 ' HA ' ' HG3' ' A' ' 43' ' ' GLN . 1.2 p -96.81 155.56 16.72 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.199 -0.455 . . . . 73.25 111.138 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 57.68 20.63 40.13 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.736 -0.745 . . . . 64.24 112.49 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.0 mtt -99.81 158.91 15.46 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.759 0.314 . . . . 75.23 110.917 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 23.4 tp -174.63 78.54 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.287 -0.415 . . . . 74.32 110.928 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 178.8 -31.22 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.242 -0.435 . . . . 61.31 110.905 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 8.5 m -91.14 -99.81 0.11 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.159 -0.473 . . . . 75.25 110.867 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 42.6 ttt85 -84.96 -29.36 25.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.11 -0.496 . . . . 74.13 110.857 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 93.1 t -64.23 -41.61 92.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.208 -0.451 . . . . 72.2 111.117 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -75.09 -31.72 25.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.192 -0.458 . . . . 75.2 111.11 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -63.58 -44.39 94.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.186 -0.461 . . . . 73.45 110.863 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 24.3 pt -67.32 -30.1 47.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 74.52 111.132 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 1.5 mmm -66.03 -36.22 82.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.159 -0.473 . . . . 74.01 110.931 179.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -87.74 -22.74 24.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 45.15 110.916 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 34.7 mttp -80.4 145.11 58.8 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.561 0.696 . . . . 75.32 110.888 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.81 161.08 47.31 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.689 2.259 . . . . 72.11 112.358 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 29.0 ttp180 -161.65 -82.5 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.195 -0.457 . . . . 73.22 110.903 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -145.36 156.45 43.79 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.175 -0.466 . . . . 72.31 110.878 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.548 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -96.79 14.23 64.28 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.721 -0.752 . . . . 64.23 112.452 -179.862 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -111.22 142.09 25.68 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.636 0.731 . . . . 74.23 111.098 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.82 178.21 4.84 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.65 2.234 . . . . 63.44 112.367 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -107.97 -2.9 19.31 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.25 -0.432 . . . . 74.45 110.841 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -141.83 129.74 21.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.224 -0.443 . . . . 73.52 111.166 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -131.08 170.43 14.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.188 -0.46 . . . . 73.13 111.142 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -179.74 96.32 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.222 -0.445 . . . . 74.13 110.894 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 6.4 p90 -150.37 84.99 1.38 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.145 -0.479 . . . . 71.51 110.943 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 57.26 179.2 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.101 -0.5 . . . . 74.2 110.841 -179.841 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.9 mp -136.66 62.2 1.61 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.127 -0.488 . . . . 70.34 110.903 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . 0.469 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 1.7 m-85 -69.13 -60.75 3.93 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.669 0.747 . . . . 71.24 110.885 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.469 ' HD2' ' N ' ' A' ' 78' ' ' PHE . 53.6 Cg_endo -69.78 132.69 23.84 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.643 2.229 . . . . 73.34 112.362 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -66.49 129.2 39.03 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.185 -0.461 . . . . 74.43 110.915 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 62.88 159.63 0.12 Allowed Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.665 0.745 . . . . 70.4 110.828 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.81 -49.7 0.53 Allowed 'Trans proline' 0 C--O 1.232 0.182 0 C-N-CA 122.666 2.244 . . . . 72.25 112.309 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 8.5 mttp -83.31 168.43 16.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.252 -0.431 . . . . 72.53 110.913 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . 0.5 ' CD1' ' HA ' ' A' ' 200' ' ' LEU . 35.4 m95 -53.55 131.78 39.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.248 -0.433 . . . . 73.31 110.957 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.23 1.03 13.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.272 -0.422 . . . . 71.34 111.154 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.2 m -73.39 178.28 4.68 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.237 -0.438 . . . . 73.12 110.843 -179.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.81 -10.22 22.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.135 -0.484 . . . . 71.12 110.882 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -156.18 142.85 10.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.221 -0.445 . . . . 74.14 111.073 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 76.8 t -116.65 130.33 71.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.15 -0.477 . . . . 72.25 111.081 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -118.45 144.57 45.89 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.115 -0.493 . . . . 75.51 111.124 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 4.6 p90 -137.62 146.38 43.87 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.202 -0.454 . . . . 70.51 110.937 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 6.1 ttt180 -149.4 131.68 15.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.113 -0.494 . . . . 74.3 110.833 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.463 HD11 ' HA ' ' A' ' 106' ' ' ASP . 4.8 mp -75.18 132.52 33.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.191 -0.459 . . . . 72.4 111.13 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 21.6 t -86.25 -40.25 14.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.163 -0.471 . . . . 74.41 111.112 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 92.0 p -156.42 169.34 24.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.172 -0.467 . . . . 64.24 110.818 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 11.5 p90 -125.39 154.98 41.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.126 -0.488 . . . . 74.1 110.911 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.9 t -96.59 141.14 30.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.159 -0.473 . . . . 75.33 111.097 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 2.6 mmp_? -53.06 -18.22 1.97 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 72.14 110.827 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.94 -35.92 82.71 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.196 -0.456 . . . . 74.13 110.894 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -141.86 153.7 64.65 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.602 0.715 . . . . 72.52 110.89 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . 0.421 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.6 Cg_endo -69.77 151.02 68.88 Favored 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.692 2.262 . . . . 73.11 112.356 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 11.8 t-160 -52.36 -27.6 16.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.229 -0.441 . . . . 74.11 110.833 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.421 HG22 ' HB2' ' A' ' 101' ' ' PRO . 0.0 OUTLIER -75.37 -40.5 42.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.232 -0.44 . . . . 74.02 111.141 179.991 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 3.6 m -69.83 -38.42 76.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.138 -0.483 . . . . 54.24 111.184 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 81.3 t -72.81 -45.55 56.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.173 -0.467 . . . . 73.13 111.134 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.625 ' O ' HG23 ' A' ' 109' ' ' VAL . 2.6 t0 -63.41 -42.6 98.77 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.183 -0.462 . . . . 63.44 110.829 179.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 11.2 ptm180 -70.11 -34.15 72.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.462 . . . . 75.02 110.87 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.567 ' HB3' ' HD2' ' A' ' 188' ' ' PHE . 0.0 OUTLIER -62.08 -48.73 78.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.217 -0.447 . . . . 75.05 110.914 -179.969 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.625 HG23 ' O ' ' A' ' 106' ' ' ASP . 1.5 m -55.4 -42.12 65.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.454 . . . . 72.31 111.114 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.469 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 48.0 t -70.22 -33.36 71.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.223 -0.444 . . . . 72.14 110.894 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.84 -32.82 73.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.15 -0.477 . . . . 74.35 110.876 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -97.48 -40.31 8.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.198 -0.456 . . . . 74.32 111.059 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.26 -33.58 76.33 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.243 -0.435 . . . . 74.11 110.88 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 46.6 t30 -69.74 -40.55 76.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 75.15 110.9 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.86 -34.56 71.75 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.206 -0.452 . . . . 74.0 110.868 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 7.8 m95 -66.45 -41.33 89.25 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.211 -0.45 . . . . 75.23 110.915 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -72.72 -38.85 56.66 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.761 -0.733 . . . . 73.44 112.471 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.0 mmpt? -62.66 -16.3 56.28 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.758 0.313 . . . . 74.42 110.921 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 37.2 mm-40 -100.4 13.33 34.83 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.222 -0.444 . . . . 75.55 110.892 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.405 HG13 ' HB2' ' A' ' 122' ' ' LEU . 6.4 pt -148.09 152.62 40.22 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.601 0.715 . . . . 71.34 111.136 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.74 1.21 4.63 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.685 2.257 . . . . 75.35 112.325 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.407 ' HB3' ' H ' ' A' ' 123' ' ' HIS . 4.3 mt -62.63 -156.61 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.228 -0.442 . . . . 73.22 110.936 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.407 ' H ' ' HB3' ' A' ' 122' ' ' LEU . 5.7 t60 -160.56 142.61 12.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.151 -0.477 . . . . 74.12 110.837 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 28.5 m-85 -121.59 148.52 44.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.182 -0.463 . . . . 75.54 110.849 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -126.97 141.69 51.73 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.136 -0.484 . . . . 75.14 110.93 -179.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.63 148.61 30.18 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.235 -0.439 . . . . 74.04 110.937 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 25.6 m -103.14 126.31 57.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.278 -0.419 . . . . 50.13 111.087 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -144.34 -11.11 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.163 -0.471 . . . . 74.43 111.081 179.945 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -157.44 109.17 2.35 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.193 -0.458 . . . . 73.32 110.949 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 109.77 -162.65 12.62 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.758 -0.734 . . . . 62.11 112.485 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 9.7 p -101.96 156.06 17.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.759 0.314 . . . . 71.11 111.13 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -111.77 165.39 12.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.186 -0.461 . . . . 72.32 111.098 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -71.88 -55.13 8.07 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.22 -0.445 . . . . 75.41 110.825 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 5.0 mp -95.37 108.8 21.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.251 -0.432 . . . . 71.04 111.114 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 14.2 mmm -90.76 127.75 36.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.189 -0.459 . . . . 72.43 110.941 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -106.24 95.14 3.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.263 -0.426 . . . . 70.04 111.147 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -132.06 163.52 23.88 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.753 -0.737 . . . . 63.34 112.517 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 49.9 m-85 -105.22 150.03 25.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.864 0.364 . . . . 74.01 110.885 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . 174.45 166.89 0.24 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.107 -0.497 . . . . 71.21 111.122 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 29.4 mtm180 -104.41 173.2 6.4 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.211 -0.45 . . . . 72.34 110.865 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -57.28 -15.91 17.82 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.758 -0.734 . . . . 74.24 112.464 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -96.51 13.3 28.49 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.756 0.312 . . . . 75.03 111.039 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 4.1 p80 -75.81 -5.15 44.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.245 -0.434 . . . . 73.45 110.862 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 121.37 20.41 3.28 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.741 -0.742 . . . . 60.43 112.498 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -124.76 173.31 8.66 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.843 0.354 . . . . 72.14 110.864 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 20.5 m -75.42 170.51 15.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.196 -0.456 . . . . 64.54 110.846 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 64.89 132.57 0.03 OUTLIER Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.703 0.763 . . . . 73.4 110.928 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 152.01 69.11 Favored 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.708 2.272 . . . . 74.53 112.372 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' PHE . . . . . 0.492 ' C ' ' H ' ' A' ' 151' ' ' GLY . 21.3 p90 -53.01 -41.4 64.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.243 -0.435 . . . . 70.0 110.877 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 76.19 -25.13 0.21 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.171 -0.468 . . . . 72.24 110.902 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . 0.492 ' H ' ' C ' ' A' ' 149' ' ' PHE . . . 77.07 -151.35 38.68 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.74 -0.743 . . . . 75.42 112.481 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.75 142.15 47.18 Favored 'Trans proline' 0 C--N 1.341 0.137 0 C-N-CA 122.704 2.269 . . . . 75.11 112.333 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . 0.434 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 104.15 -137.19 13.43 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.725 -0.75 . . . . 70.32 112.418 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 154' ' ' ASN . . . . . 0.434 ' C ' ' O ' ' A' ' 153' ' ' GLY . 4.1 p30 -34.53 138.09 0.11 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.955 0.407 . . . . 74.45 110.886 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 1.5 m 73.29 112.23 0.06 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.166 -0.47 . . . . 63.14 111.171 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . 0.456 HD13 HG13 ' A' ' 186' ' ' ILE . 0.6 OUTLIER -94.92 -53.09 3.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.244 -0.434 . . . . 75.02 110.918 179.975 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . 0.548 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -163.85 148.58 10.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.201 -0.454 . . . . 73.44 111.107 179.773 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 16.1 p-80 -106.8 124.37 49.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 74.34 110.917 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -110.48 152.39 26.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.254 -0.43 . . . . 74.42 111.108 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -105.46 151.86 23.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.231 -0.44 . . . . 75.31 110.876 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -82.79 164.06 48.56 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.581 0.705 . . . . 71.14 111.111 179.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.79 79.17 0.97 Allowed 'Trans proline' 0 C--N 1.34 0.127 0 C-N-CA 122.661 2.241 . . . . 74.44 112.347 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -137.98 124.71 3.03 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.73 -0.748 . . . . 72.32 112.497 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 63.31 -171.1 0.17 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.797 0.332 . . . . 73.1 111.135 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -86.0 -41.32 7.17 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.74 -0.743 . . . . 74.03 112.465 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 10.2 tt -71.32 -37.21 71.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.837 0.351 . . . . 75.02 110.913 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -79.11 161.24 47.12 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.766 -0.731 . . . . 43.43 112.488 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 91.29 23.08 30.24 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.765 -0.731 . . . . 74.31 112.54 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -94.42 167.03 11.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.848 0.356 . . . . 63.41 110.878 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.46 130.69 55.9 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.207 -0.451 . . . . 74.21 111.105 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 24.6 m170 -126.29 158.6 35.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.225 -0.443 . . . . 72.53 110.881 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -142.99 138.83 30.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.208 -0.451 . . . . 71.44 110.85 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 59.2 t0 -69.21 97.8 0.96 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.138 -0.483 . . . . 74.11 110.887 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.41 -17.04 10.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.228 -0.442 . . . . 74.45 110.844 -179.869 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -78.97 -16.12 57.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.464 . . . . 73.32 110.824 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -80.13 -174.96 4.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.229 -0.441 . . . . 71.41 110.911 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 24.7 mtm-85 -109.41 107.23 17.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 74.32 110.877 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 68.2 m95 -108.56 137.17 46.94 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.219 -0.446 . . . . 74.32 110.945 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 11.1 t -178.33 163.59 1.63 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.266 -0.425 . . . . 74.13 111.14 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -125.54 -72.59 0.66 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.18 -0.464 . . . . 61.52 110.871 179.89 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -60.25 -16.16 40.83 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.702 -0.761 . . . . 62.41 112.514 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 182' ' ' SER . . . . . 0.432 ' O ' ' C ' ' A' ' 183' ' ' SER . 0.3 OUTLIER -90.62 -24.38 20.54 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.909 0.385 . . . . 74.0 110.933 -179.781 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 183' ' ' SER . . . . . 0.432 ' C ' ' O ' ' A' ' 182' ' ' SER . 91.0 p 35.61 58.17 0.87 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.087 -0.506 . . . . 64.12 110.866 -179.847 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 9.1 tt -116.75 -33.5 4.79 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.09 -0.505 . . . . 74.43 110.91 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -119.38 -139.29 5.94 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.752 -0.737 . . . . 74.22 112.488 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 186' ' ' ILE . . . . . 0.456 HG13 HD13 ' A' ' 156' ' ' LEU . 8.5 mm -79.54 100.32 4.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.882 0.372 . . . . 73.22 111.162 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -48.96 119.13 2.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.136 -0.484 . . . . 71.31 110.888 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 188' ' ' PHE . . . . . 0.567 ' HD2' ' HB3' ' A' ' 108' ' ' LEU . 1.2 t80 -53.72 -34.36 58.6 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.172 -0.467 . . . . 75.45 110.891 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . 0.413 HD21 HD11 ' A' ' 108' ' ' LEU . 0.2 OUTLIER -67.16 -48.18 68.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.15 -0.477 . . . . 60.14 110.939 -179.991 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -70.12 -37.75 75.41 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.204 -0.453 . . . . 74.22 110.912 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -72.63 -35.47 67.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.104 -0.498 . . . . 61.32 111.138 179.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 192' ' ' ALA . . . . . 0.48 ' O ' ' HB2' ' A' ' 196' ' ' LEU . . . -60.79 -45.09 95.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.193 -0.458 . . . . 52.32 111.121 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 11.1 m -58.76 -44.99 90.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.17 -0.468 . . . . 72.43 111.12 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 6.8 t60 -73.04 -39.79 65.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.216 -0.447 . . . . 71.44 110.857 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -71.76 -48.13 48.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.178 -0.464 . . . . 71.01 111.102 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 196' ' ' LEU . . . . . 0.483 ' N ' HD23 ' A' ' 196' ' ' LEU . 4.5 mm? -62.11 -37.01 83.46 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.243 -0.435 . . . . 74.52 110.917 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -60.74 -27.69 66.91 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.762 -0.733 . . . . 62.43 112.512 179.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 198' ' ' HIS . . . . . . . . . . . . . 6.5 m-70 -67.31 -35.07 78.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.752 0.31 . . . . 75.21 110.806 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -68.73 -21.46 64.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.214 -0.448 . . . . 73.13 110.855 -179.774 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 200' ' ' LEU . . . . . 0.5 ' HA ' ' CD1' ' A' ' 84' ' ' TRP . 0.5 OUTLIER -88.53 2.11 53.57 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.12 -0.491 . . . . 75.12 110.91 -179.992 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 84.04 -7.67 70.03 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.731 -0.747 . . . . 50.41 112.474 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 202' ' ' MET . . . . . . . . . . . . . 98.7 mmm -53.92 167.47 0.27 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.781 0.324 . . . . 71.04 110.868 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -137.1 161.4 25.18 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.719 -0.753 . . . . 64.44 112.512 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 13.2 m-70 -57.43 143.85 38.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.824 0.345 . . . . 74.32 110.835 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -105.92 152.52 23.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 72.42 110.897 -179.835 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 206' ' ' SER . . . . . 0.423 ' HB3' ' HA2' ' A' ' 47' ' ' GLY . 1.1 m -88.07 -4.77 58.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.156 -0.474 . . . . 72.22 110.853 -179.802 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.55 138.98 83.52 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-O 121.603 0.716 . . . . 65.11 110.865 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 -7.92 22.29 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.684 2.256 . . . . 74.53 112.36 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 -125.72 28.91 6.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.234 -0.439 . . . . 63.52 110.915 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 210' ' ' ALA . . . . . 0.416 ' O ' ' HB2' ' A' ' 213' ' ' TYR . . . -87.11 145.61 26.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.151 -0.477 . . . . 64.4 111.09 179.879 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -73.24 -26.05 22.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.459 . . . . 75.23 111.158 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 11.3 mmm -93.78 10.07 34.56 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.138 -0.483 . . . . 75.22 110.884 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 213' ' ' TYR . . . . . 0.425 ' CD1' ' HD2' ' A' ' 214' ' ' PRO . 0.5 OUTLIER -55.54 127.54 66.45 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.669 0.747 . . . . 73.43 110.918 -179.865 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 214' ' ' PRO . . . . . 0.425 ' HD2' ' CD1' ' A' ' 213' ' ' TYR . 54.0 Cg_endo -69.75 -18.47 37.03 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.634 2.222 . . . . 63.01 112.379 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 1.2 p -90.16 32.16 0.95 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.197 -0.456 . . . . 74.24 111.129 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 6.5 t80 -51.11 123.38 9.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.175 -0.466 . . . . 74.42 110.929 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . 149.26 90.88 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.793 -0.717 . . . . 74.22 112.535 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -179.12 -170.89 0.19 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.891 0.377 . . . . 64.22 110.857 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . -53.14 105.76 0.32 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.751 -0.738 . . . . 73.55 112.505 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 220' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -102.51 101.41 19.89 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.583 0.706 . . . . 73.41 110.923 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.77 159.99 51.35 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.702 2.268 . . . . 74.21 112.322 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -71.2 -18.56 62.47 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.215 -0.448 . . . . 75.43 110.909 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -96.39 10.01 39.47 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.171 -0.468 . . . . 70.33 110.91 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -51.75 127.28 20.26 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.143 -0.48 . . . . 71.11 110.871 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.98 -164.68 1.94 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.123 -0.49 . . . . 65.02 110.883 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -59.28 148.77 30.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.255 -0.43 . . . . 62.53 110.863 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 227' ' ' SER . . . . . 0.407 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 10.5 t -86.93 163.43 17.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.184 -0.462 . . . . 74.21 110.841 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -64.88 -62.28 1.66 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.092 -0.504 . . . . 74.54 110.889 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -55.57 -28.47 55.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.179 -0.464 . . . . 74.2 110.833 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -69.22 -48.61 61.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.181 -0.463 . . . . 74.23 110.892 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 231' ' ' ILE . . . . . . . . . . . . . 7.9 mt -68.86 -41.73 82.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.165 -0.471 . . . . 73.41 111.123 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 33.7 pttt -65.65 -32.58 74.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.193 -0.458 . . . . 73.32 110.873 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -64.88 -47.22 85.34 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.773 -0.727 . . . . 65.45 112.466 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 8.5 tt -72.55 -30.32 33.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.792 0.329 . . . . 74.41 111.123 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -68.73 -23.81 64.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.181 -0.463 . . . . 71.13 110.896 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 236' ' ' LYS . . . . . 0.475 ' HD3' ' N ' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.31 -27.98 60.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.168 -0.469 . . . . 74.41 110.909 179.975 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 237' ' ' LEU . . . . . 0.475 ' N ' ' HD3' ' A' ' 236' ' ' LYS . 9.9 tt -95.77 -31.25 13.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.199 -0.455 . . . . 75.41 110.901 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 238' ' ' TYR . . . . . . . . . . . . . 30.7 m-85 -92.02 -35.03 14.18 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.199 -0.455 . . . . 54.42 110.953 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -128.01 -120.24 2.29 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.781 -0.724 . . . . 72.22 112.506 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.43 152.13 20.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.771 0.32 . . . . 75.42 110.917 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 5.1 ptm180 -100.85 169.58 8.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.205 -0.452 . . . . 73.34 110.914 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 3.6 m -165.78 61.24 0.11 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.22 -0.445 . . . . 62.43 110.883 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 3.1 t30 61.61 100.35 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.152 -0.476 . . . . 72.13 110.884 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 32.4 p -133.1 -170.71 2.52 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.209 -0.45 . . . . 71.41 110.857 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -125.51 -173.84 2.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.124 -0.489 . . . . 75.43 110.886 -179.942 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.87 178.64 7.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.191 -0.459 . . . . 72.11 110.91 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 116.269 -0.423 . . . . 74.13 110.902 179.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 302' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' -2' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.108 0 CA-C-O 121.613 0.72 . . . . 73.02 110.926 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' -1' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 144.62 54.48 Favored 'Trans proline' 0 C--O 1.233 0.26 0 C-N-CA 122.675 2.25 . . . . 73.21 112.34 179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 8.1 mt -145.3 73.7 14.26 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.601 0.715 . . . . 75.23 110.932 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.73 -172.0 0.53 Allowed 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.694 2.263 . . . . 64.24 112.369 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -150.24 72.29 1.1 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.228 -0.442 . . . . 62.24 110.898 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 26.7 mm-40 -95.07 -39.47 10.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.208 -0.451 . . . . 74.01 110.973 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -57.3 -33.96 68.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.159 -0.473 . . . . 71.4 111.162 179.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -55.88 -21.71 31.39 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.705 -0.76 . . . . 62.21 112.532 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -108.29 21.65 28.43 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.755 -0.736 . . . . 54.42 112.445 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -88.52 164.28 15.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.694 0.283 . . . . 72.23 110.895 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -82.92 168.69 16.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.231 -0.44 . . . . 73.24 110.866 -179.79 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -55.41 -31.99 62.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.149 -0.478 . . . . 73.44 110.904 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -63.11 -42.79 99.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.165 -0.471 . . . . 72.33 110.905 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -65.19 -40.59 94.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.238 -0.437 . . . . 72.14 110.892 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 16.2 t-105 -73.08 -33.92 65.92 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.204 -0.453 . . . . 71.22 110.898 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -67.16 -35.59 80.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.2 -0.454 . . . . 72.51 110.853 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.51 -37.61 88.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.183 -0.462 . . . . 74.32 110.908 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.1 -37.25 86.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.23 -0.441 . . . . 74.22 111.106 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -65.36 -42.85 92.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.219 -0.446 . . . . 73.12 110.85 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -76.55 -31.65 57.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.289 -0.414 . . . . 72.4 110.855 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -60.36 -43.65 96.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.213 -0.449 . . . . 75.11 110.934 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -71.4 -21.24 62.02 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.15 -0.477 . . . . 75.43 110.93 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -71.55 -48.24 49.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.221 -0.445 . . . . 75.45 110.852 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.83 -28.53 69.92 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.258 -0.428 . . . . 74.22 110.883 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -62.59 -25.26 67.99 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.18 -0.464 . . . . 75.2 110.861 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -120.66 50.11 1.37 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.125 -0.489 . . . . 74.4 110.937 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.7 mt 56.97 -169.39 0.1 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.076 -0.511 . . . . 75.43 110.929 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -98.82 90.05 4.54 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.158 -0.474 . . . . 71.41 110.942 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -114.56 124.89 53.01 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.08 -0.509 . . . . 74.25 110.88 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 82.5 p -85.11 -6.32 59.31 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.252 -0.431 . . . . 62.15 110.854 -179.767 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -64.18 -14.37 54.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.155 -0.475 . . . . 74.51 110.858 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.79 9.47 18.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.139 -0.482 . . . . 72.53 111.155 -179.844 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 7.4 tttm -51.45 170.09 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.165 -0.47 . . . . 74.12 110.911 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 67.06 139.87 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.261 -0.427 . . . . 74.52 110.907 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.02 -32.14 61.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.13 -0.487 . . . . 71.02 111.028 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -59.41 -18.93 43.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.273 -0.421 . . . . 71.33 110.847 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 51.3 p -85.37 -21.61 28.78 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.162 -0.472 . . . . 74.02 110.91 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.84 -35.67 71.23 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.122 -0.49 . . . . 74.54 110.903 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.1 -51.67 62.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.26 -0.427 . . . . 73.13 110.841 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.74 -44.13 86.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.47 . . . . 71.12 111.165 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.99 -38.3 82.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.208 -0.451 . . . . 74.43 110.844 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.6 mp -67.45 -35.49 79.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.232 -0.44 . . . . 74.44 110.956 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.46 -45.93 87.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 74.2 110.899 179.863 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.545 ' HG3' ' N ' ' A' ' 42' ' ' MET . 0.0 OUTLIER -60.34 -31.92 70.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 75.11 110.943 179.902 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.545 ' N ' ' HG3' ' A' ' 41' ' ' GLU . 1.4 ttt -68.27 -34.23 75.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.098 -0.501 . . . . 63.43 110.904 179.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.417 ' HG3' ' HA ' ' A' ' 51' ' ' THR . 1.5 mm-40 -62.22 -39.48 92.95 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.242 -0.435 . . . . 75.32 110.911 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.1 mmpt? -68.59 -27.33 65.96 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.209 -0.45 . . . . 75.11 110.908 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 34.4 t80 -69.79 -45.63 67.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.225 -0.443 . . . . 73.32 110.898 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 -82.83 -34.52 26.86 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.096 -0.502 . . . . 70.43 110.907 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 100.13 -3.05 56.77 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.719 -0.753 . . . . 64.42 112.486 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.86 142.17 88.79 Favored Pre-proline 0 C--N 1.328 -0.356 0 CA-C-O 121.616 0.722 . . . . 74.31 110.856 -179.847 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.77 -52.55 0.32 Allowed 'Trans proline' 0 C--N 1.342 0.219 0 C-N-CA 122.706 2.271 . . . . 74.5 112.314 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -52.67 108.24 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.262 -0.427 . . . . 72.24 111.128 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.417 ' HA ' ' HG3' ' A' ' 43' ' ' GLN . 1.5 t -108.58 158.5 17.51 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.214 -0.448 . . . . 73.25 111.153 179.93 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 58.61 18.06 36.41 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.722 -0.752 . . . . 64.24 112.545 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 1.9 mmm -118.95 161.14 20.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.799 0.333 . . . . 75.23 110.902 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 53.2 tp -157.64 83.87 0.89 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.273 -0.421 . . . . 74.32 110.961 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -179.59 -31.9 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.173 -0.467 . . . . 61.31 110.859 179.951 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 28.9 t -80.12 -101.3 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.211 -0.449 . . . . 75.25 110.832 -179.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -84.89 -28.15 26.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 74.13 110.924 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.461 ' O ' HG13 ' A' ' 61' ' ' ILE . 90.5 t -59.52 -43.35 90.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.188 -0.46 . . . . 72.2 111.066 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 3.9 mm -75.13 -31.36 24.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.199 -0.455 . . . . 75.2 111.105 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -59.56 -44.08 93.38 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 73.45 110.923 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.461 HG13 ' O ' ' A' ' 58' ' ' VAL . 1.6 pp -74.57 -29.25 23.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.18 -0.464 . . . . 74.52 111.157 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -57.95 -41.25 82.42 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.194 -0.457 . . . . 74.01 110.903 179.794 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -89.33 -24.47 21.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.26 -0.427 . . . . 45.15 110.888 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 10.2 mttm -85.22 120.05 72.99 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.594 0.711 . . . . 75.32 110.894 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.73 151.63 69.25 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.686 2.258 . . . . 72.11 112.36 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.76 -64.2 0.22 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.176 -0.465 . . . . 73.22 110.825 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 13.9 p -145.04 149.6 35.39 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.237 -0.438 . . . . 72.31 110.885 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.582 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -104.72 18.26 44.21 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.733 -0.746 . . . . 64.23 112.456 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -96.16 135.54 22.6 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.576 0.703 . . . . 74.23 111.175 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -69.87 143.06 49.1 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.677 2.251 . . . . 63.44 112.268 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -100.2 26.49 6.46 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.164 -0.471 . . . . 74.45 110.858 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -130.5 129.41 64.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.176 -0.466 . . . . 73.52 111.152 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -131.01 170.55 14.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.183 -0.462 . . . . 73.13 111.146 179.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -145.29 105.97 4.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.24 -0.436 . . . . 74.13 110.883 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 28.6 m-85 -51.74 129.32 25.98 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.195 -0.457 . . . . 71.51 110.871 -179.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -179.62 100.58 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.058 -0.519 . . . . 74.2 110.895 -179.87 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 55.95 21.9 5.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.127 -0.488 . . . . 70.34 110.932 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 32.0 p90 -49.78 153.39 2.15 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.65 0.738 . . . . 71.24 110.878 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.82 126.8 13.69 Favored 'Trans proline' 0 C--N 1.343 0.238 0 C-N-CA 122.636 2.224 . . . . 73.34 112.304 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -50.93 127.31 18.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.195 -0.457 . . . . 74.43 110.842 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 63.06 104.42 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.674 0.749 . . . . 70.4 110.841 -179.904 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.498 ' HG2' ' H ' ' A' ' 83' ' ' LYS . 53.8 Cg_endo -69.69 -72.13 0.02 OUTLIER 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.694 2.263 . . . . 72.25 112.368 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.498 ' H ' ' HG2' ' A' ' 82' ' ' PRO . 4.4 mttp -45.13 141.86 2.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.199 -0.455 . . . . 72.53 110.914 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . 0.431 ' CE2' HD22 ' A' ' 200' ' ' LEU . 40.5 m0 -47.05 109.87 0.24 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.223 -0.444 . . . . 73.31 110.907 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -114.09 -6.98 13.09 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.288 -0.414 . . . . 71.34 111.146 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -58.18 168.64 0.99 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.209 -0.45 . . . . 73.12 110.883 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 18.7 mttp -73.96 -30.55 62.59 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.095 -0.502 . . . . 71.12 110.942 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -159.84 144.93 6.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.215 -0.448 . . . . 74.14 111.17 179.841 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 13.0 t -126.2 140.96 47.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.194 -0.457 . . . . 72.25 111.082 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 76.8 p -122.38 166.52 14.58 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.172 -0.467 . . . . 75.51 111.17 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 3.9 p90 -151.42 146.29 25.85 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.261 -0.427 . . . . 70.51 110.915 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 17.2 ttt180 -146.33 137.42 24.4 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.139 -0.482 . . . . 74.3 110.952 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.438 HD12 ' HA ' ' A' ' 106' ' ' ASP . 3.5 mp -75.0 135.44 27.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.182 -0.463 . . . . 72.4 111.144 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.445 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 21.8 t -89.25 -40.63 13.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.225 -0.443 . . . . 74.41 111.114 179.846 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 1.7 t -143.74 161.83 37.59 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.197 -0.456 . . . . 64.24 110.861 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 11.8 p90 -110.19 153.25 25.03 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.129 -0.487 . . . . 74.1 110.901 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' THR . . . . . 0.437 ' O ' ' O ' ' A' ' 100' ' ' LEU . 0.2 OUTLIER -82.61 140.94 32.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.139 -0.482 . . . . 75.33 111.112 -179.966 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 6.5 ppt_? -73.67 -7.66 52.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.276 -0.42 . . . . 72.14 110.863 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -96.57 -25.98 15.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.194 -0.457 . . . . 74.13 110.869 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.437 ' O ' ' O ' ' A' ' 97' ' ' THR . 0.6 OUTLIER -133.64 153.73 80.32 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.599 0.714 . . . . 72.52 110.914 -179.959 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . 0.421 ' HB2' HG21 ' A' ' 103' ' ' ILE . 53.9 Cg_endo -69.69 150.91 69.24 Favored 'Trans proline' 0 C--O 1.231 0.151 0 C-N-CA 122.723 2.282 . . . . 73.11 112.318 179.902 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 16.3 t-160 -53.35 -25.57 15.73 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.233 -0.44 . . . . 74.11 110.83 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.421 HG21 ' HB2' ' A' ' 101' ' ' PRO . 13.2 tt -76.58 -38.74 31.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.231 -0.441 . . . . 74.02 111.134 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 3.1 m -69.21 -39.94 78.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.197 -0.456 . . . . 54.24 111.197 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 91.6 t -72.7 -45.95 55.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 73.13 111.169 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.608 ' O ' HG23 ' A' ' 109' ' ' VAL . 4.8 t0 -63.41 -43.33 97.81 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.108 -0.496 . . . . 63.44 110.831 179.939 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -70.16 -33.63 72.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.139 -0.482 . . . . 75.02 110.825 -179.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.57 ' HB3' ' HD2' ' A' ' 188' ' ' PHE . 0.0 OUTLIER -60.7 -48.72 80.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.216 -0.447 . . . . 75.05 110.937 -179.989 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.608 HG23 ' O ' ' A' ' 106' ' ' ASP . 1.5 m -55.28 -41.58 62.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.263 -0.426 . . . . 72.31 111.132 179.836 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.461 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 42.9 t -70.13 -33.43 71.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 72.14 110.906 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -61.93 -32.92 73.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.081 -0.509 . . . . 74.35 110.875 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.69 -40.91 8.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.239 -0.437 . . . . 74.32 111.13 179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.69 -34.12 77.46 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.199 -0.455 . . . . 74.11 110.971 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -69.36 -35.11 75.53 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.199 -0.455 . . . . 75.15 110.904 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.07 -34.98 78.84 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.181 -0.463 . . . . 74.0 110.963 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 6.8 m95 -64.47 -49.18 72.41 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.216 -0.447 . . . . 75.23 110.92 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . 0.407 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -71.84 -29.86 66.7 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.703 -0.761 . . . . 73.44 112.479 -179.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.2 mtmt -61.36 -17.71 55.24 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.817 0.342 . . . . 74.42 110.923 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -97.96 13.26 31.4 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.124 -0.489 . . . . 75.55 110.901 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.529 ' C ' ' H ' ' A' ' 122' ' ' LEU . 3.3 pt -148.28 144.96 19.37 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.631 0.729 . . . . 71.34 111.096 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.69 28.17 0.18 Allowed 'Trans proline' 0 C--O 1.232 0.206 0 C-N-CA 122.72 2.28 . . . . 75.35 112.316 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.529 ' H ' ' C ' ' A' ' 120' ' ' ILE . 10.3 mt -76.83 -160.25 0.15 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.275 -0.42 . . . . 73.22 110.911 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.414 ' H ' ' HB3' ' A' ' 122' ' ' LEU . 3.4 t-160 -153.49 120.95 5.88 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.165 -0.47 . . . . 74.12 110.831 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 9.3 m-30 -110.31 142.74 41.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.189 -0.46 . . . . 75.54 110.838 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -123.84 141.23 52.22 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.123 -0.49 . . . . 75.14 110.857 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.14 157.79 25.19 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.188 -0.46 . . . . 74.04 110.894 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 25.2 m -103.15 126.32 57.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.208 -0.451 . . . . 50.13 111.149 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -145.82 -10.77 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.227 -0.442 . . . . 74.43 111.164 179.878 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -156.57 109.18 2.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.177 -0.465 . . . . 73.32 110.888 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 105.28 -163.34 14.24 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.754 -0.736 . . . . 62.11 112.471 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -101.88 156.42 17.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.792 0.329 . . . . 71.11 111.101 -179.836 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -111.41 165.27 12.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.16 -0.473 . . . . 72.32 111.127 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -76.74 -53.69 7.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.269 -0.423 . . . . 75.41 110.918 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . 0.441 ' CD1' ' N ' ' A' ' 134' ' ' ILE . 1.9 mp -89.92 107.76 18.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.21 -0.45 . . . . 71.04 111.085 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' MET . . . . . 0.445 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 22.0 mmm -95.79 130.94 42.57 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.15 -0.477 . . . . 72.43 110.878 179.814 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -111.22 90.29 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.186 -0.461 . . . . 70.04 111.113 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -130.02 167.46 21.72 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.769 -0.729 . . . . 63.34 112.522 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 46.8 m-85 -105.49 150.88 24.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.9 0.381 . . . . 74.01 110.908 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . 177.01 167.42 0.54 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.179 -0.464 . . . . 71.21 111.13 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 6.7 mtp180 -103.94 173.09 6.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.172 -0.467 . . . . 72.34 110.913 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -57.91 -15.55 20.89 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.73 -0.747 . . . . 74.24 112.506 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -98.74 13.32 32.68 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.831 0.348 . . . . 75.03 111.104 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 6.2 p80 -71.48 -9.36 58.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.242 -0.435 . . . . 73.45 110.871 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 118.99 49.84 0.32 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.748 -0.739 . . . . 60.43 112.461 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -170.23 -176.78 2.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.767 0.318 . . . . 72.14 110.877 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -76.19 -179.74 5.21 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.259 -0.428 . . . . 64.54 110.903 -179.787 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' TYR . . . . . 0.403 ' HA ' ' HD2' ' A' ' 148' ' ' PRO . 0.2 OUTLIER 65.01 107.31 0.03 OUTLIER Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 121.656 0.741 . . . . 73.4 110.863 -179.922 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . 0.403 ' HD2' ' HA ' ' A' ' 147' ' ' TYR . 53.8 Cg_endo -69.76 151.9 69.19 Favored 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.689 2.259 . . . . 74.53 112.334 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 149' ' ' PHE . . . . . 0.419 ' O ' ' CG ' ' A' ' 150' ' ' ASP . 0.4 OUTLIER -53.43 -25.51 16.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.242 -0.435 . . . . 70.0 110.89 179.98 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . 0.419 ' CG ' ' O ' ' A' ' 149' ' ' PHE . 2.0 p30 45.38 24.44 0.16 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.151 -0.477 . . . . 72.24 110.821 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 42.62 -160.52 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.743 -0.741 . . . . 75.42 112.511 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 144.55 54.38 Favored 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.701 2.267 . . . . 75.11 112.312 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . 0.457 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 105.97 -133.87 11.82 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.673 -0.775 . . . . 70.32 112.471 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 154' ' ' ASN . . . . . 0.457 ' C ' ' O ' ' A' ' 153' ' ' GLY . 3.3 p30 -33.67 136.64 0.11 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.906 0.384 . . . . 74.45 110.883 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 75.35 107.77 0.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.124 -0.489 . . . . 63.14 111.132 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . 0.471 HD12 HG13 ' A' ' 186' ' ' ILE . 0.7 OUTLIER -91.86 -55.21 3.55 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.258 -0.428 . . . . 75.02 110.949 179.924 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . 0.582 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -158.76 148.88 19.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.198 -0.456 . . . . 73.44 111.136 179.758 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 26.1 p-80 -110.41 122.59 48.07 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.262 -0.426 . . . . 74.34 110.88 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -110.52 161.1 16.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.231 -0.441 . . . . 74.42 111.075 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 18.9 m-30 -112.3 134.72 53.68 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.254 -0.43 . . . . 75.31 110.897 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -63.97 162.73 27.81 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.53 0.681 . . . . 71.14 111.091 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.73 71.59 1.49 Allowed 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.687 2.258 . . . . 74.44 112.366 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -136.08 110.1 0.78 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.776 -0.726 . . . . 72.32 112.537 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 67.1 165.93 0.22 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.89 0.376 . . . . 73.1 111.1 -179.839 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -54.72 -35.7 58.17 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.701 -0.762 . . . . 74.03 112.489 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.84 -19.53 63.46 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.896 0.379 . . . . 75.02 110.938 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -88.47 167.0 35.06 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.718 -0.753 . . . . 43.43 112.479 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 168' ' ' GLY . . . . . 0.41 ' O ' HG13 ' A' ' 134' ' ' ILE . . . 80.47 -1.95 79.91 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.81 -0.71 . . . . 74.31 112.482 -179.906 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -70.57 148.3 48.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.846 0.355 . . . . 63.41 110.835 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.3 130.16 56.04 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.215 -0.448 . . . . 74.21 111.047 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 26.5 m170 -129.69 132.18 46.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.224 -0.444 . . . . 72.53 110.885 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -114.23 138.94 49.83 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.235 -0.439 . . . . 71.44 110.849 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 57.8 t0 -70.63 97.82 1.4 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.157 -0.474 . . . . 74.11 110.877 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.92 -16.69 7.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.222 -0.445 . . . . 74.45 110.933 -179.904 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -78.39 -16.16 57.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.168 -0.469 . . . . 73.32 110.851 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -84.94 -173.54 4.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.21 -0.45 . . . . 71.41 110.885 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 45.6 mtt85 -111.75 109.73 19.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.142 -0.481 . . . . 74.32 110.872 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 70.7 m95 -109.75 138.27 46.36 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.199 -0.455 . . . . 74.32 110.884 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 11.4 t -177.76 163.54 1.86 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.279 -0.419 . . . . 74.13 111.165 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -127.29 -72.04 0.65 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.204 -0.453 . . . . 61.52 110.826 179.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -58.67 -16.94 32.21 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.668 -0.777 . . . . 62.41 112.5 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 182' ' ' SER . . . . . 0.411 ' O ' ' C ' ' A' ' 183' ' ' SER . 1.2 m -92.56 -24.32 18.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.853 0.359 . . . . 74.0 110.846 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 183' ' ' SER . . . . . 0.411 ' C ' ' O ' ' A' ' 182' ' ' SER . 4.5 p 37.36 51.82 1.18 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.187 -0.46 . . . . 64.12 110.832 -179.802 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 41.8 tp -109.18 -33.44 6.87 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.112 -0.495 . . . . 74.43 110.947 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -118.74 -138.51 5.87 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.686 -0.769 . . . . 74.22 112.401 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 186' ' ' ILE . . . . . 0.471 HG13 HD12 ' A' ' 156' ' ' LEU . 8.2 mm -79.39 101.76 4.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.908 0.385 . . . . 73.22 111.165 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -49.38 119.18 3.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.162 -0.472 . . . . 71.31 110.895 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 188' ' ' PHE . . . . . 0.57 ' HD2' ' HB3' ' A' ' 108' ' ' LEU . 1.0 OUTLIER -53.99 -33.03 55.92 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.194 -0.457 . . . . 75.45 110.87 -179.99 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . 0.409 HD21 HD12 ' A' ' 108' ' ' LEU . 0.2 OUTLIER -67.24 -48.25 68.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.11 -0.495 . . . . 60.14 110.913 -179.945 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 23.0 t80 -70.4 -37.01 74.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.234 -0.439 . . . . 74.22 110.891 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -72.65 -36.9 68.07 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.148 -0.478 . . . . 61.32 111.107 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 192' ' ' ALA . . . . . 0.448 ' O ' ' HB2' ' A' ' 196' ' ' LEU . . . -57.9 -45.08 87.02 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.209 -0.45 . . . . 52.32 111.159 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.58 -43.13 93.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.193 -0.458 . . . . 72.43 111.177 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 4.9 t60 -72.59 -38.23 67.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.3 -0.409 . . . . 71.44 110.902 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -75.17 -47.36 28.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.235 -0.439 . . . . 71.01 111.108 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 196' ' ' LEU . . . . . 0.498 HD22 ' N ' ' A' ' 196' ' ' LEU . 4.5 mm? -64.6 -43.72 92.87 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.27 -0.423 . . . . 74.52 110.908 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -57.4 -27.98 58.75 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.679 -0.772 . . . . 62.43 112.485 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 198' ' ' HIS . . . . . . . . . . . . . 4.8 m-70 -66.79 -43.88 82.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.764 0.316 . . . . 75.21 110.818 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.21 -21.83 64.2 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 73.13 110.837 -179.8 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 200' ' ' LEU . . . . . 0.431 HD22 ' CE2' ' A' ' 84' ' ' TRP . 4.3 mt -84.68 -0.93 55.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.142 -0.481 . . . . 75.12 110.97 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 83.48 -3.97 83.23 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.721 -0.752 . . . . 50.41 112.501 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 202' ' ' MET . . . . . . . . . . . . . 99.6 mmm -51.79 172.79 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.855 0.359 . . . . 71.04 110.853 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -132.73 160.17 23.71 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.746 -0.74 . . . . 64.44 112.433 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 22.6 m-70 -61.53 161.73 9.21 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.786 0.327 . . . . 74.32 110.852 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -125.05 147.49 48.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.213 -0.448 . . . . 72.42 110.846 -179.786 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 8.3 p -87.92 -3.93 58.88 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.153 -0.476 . . . . 72.22 110.877 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -70.93 137.77 85.11 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.659 0.742 . . . . 65.11 110.823 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -69.85 -6.23 18.14 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.693 2.262 . . . . 74.53 112.277 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -130.9 29.26 4.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.279 -0.419 . . . . 63.52 110.842 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 210' ' ' ALA . . . . . 0.432 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.43 145.65 26.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.277 -0.42 . . . . 64.4 111.134 179.912 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -66.91 -27.6 40.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.247 -0.433 . . . . 75.23 111.157 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 7.4 tpp -96.33 7.98 45.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.185 -0.461 . . . . 75.22 110.844 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 213' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -55.5 110.29 2.15 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.651 0.738 . . . . 73.43 110.962 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.69 -18.54 37.26 Favored 'Trans proline' 0 C--O 1.231 0.158 0 C-N-CA 122.747 2.298 . . . . 63.01 112.356 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.24 55.71 3.45 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.224 -0.444 . . . . 74.24 111.152 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 6.0 t80 -70.76 124.91 25.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 74.42 110.936 -179.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -91.7 -155.25 31.59 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.73 -0.748 . . . . 74.22 112.504 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -91.46 176.9 6.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.921 0.391 . . . . 64.22 110.867 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . 64.7 154.77 0.14 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.776 -0.726 . . . . 73.55 112.52 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 220' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -120.13 148.76 47.77 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-O 121.578 0.704 . . . . 73.41 110.884 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.85 168.66 21.03 Favored 'Trans proline' 0 C--N 1.341 0.147 0 C-N-CA 122.693 2.262 . . . . 74.21 112.302 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.93 -45.08 17.27 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.212 -0.449 . . . . 75.43 110.894 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -129.43 -40.13 1.45 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.201 -0.454 . . . . 70.33 110.9 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER 64.03 137.48 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.199 -0.455 . . . . 71.11 110.927 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -143.65 167.14 22.96 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.125 -0.489 . . . . 65.02 110.913 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.79 149.52 30.87 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.223 -0.444 . . . . 62.53 110.96 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 227' ' ' SER . . . . . 0.432 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 5.9 t -86.88 158.6 19.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.236 -0.438 . . . . 74.21 110.85 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -65.4 -65.1 0.72 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.129 -0.487 . . . . 74.54 110.933 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -55.42 -26.34 41.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.196 -0.456 . . . . 74.2 110.822 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 230' ' ' ASP . . . . . 0.407 ' HB2' ' HB3' ' A' ' 227' ' ' SER . 33.1 t70 -69.34 -48.4 61.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.231 -0.44 . . . . 74.23 110.872 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 231' ' ' ILE . . . . . . . . . . . . . 8.7 mt -68.49 -42.94 84.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.193 -0.458 . . . . 73.41 111.118 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 7.4 pttt -63.86 -32.38 73.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.137 -0.483 . . . . 73.32 110.85 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -62.95 -49.76 69.51 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.708 -0.758 . . . . 65.45 112.446 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 9.1 tt -72.97 -31.99 37.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.831 0.348 . . . . 74.41 111.187 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 11.5 mt-30 -70.9 -23.64 62.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.142 -0.481 . . . . 71.13 110.882 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 236' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.77 -28.46 61.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.175 -0.466 . . . . 74.41 110.865 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 237' ' ' LEU . . . . . . . . . . . . . 8.4 tt -97.98 -26.5 14.62 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.263 -0.426 . . . . 75.41 110.935 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 238' ' ' TYR . . . . . . . . . . . . . 15.1 m-85 -92.3 -35.28 13.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.465 . . . . 54.42 110.918 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -141.43 -119.61 1.56 Allowed Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.708 -0.758 . . . . 72.22 112.481 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 7.6 ttpp -86.07 148.71 25.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.711 0.291 . . . . 75.42 110.913 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 1.5 ptt180 -95.56 -169.55 1.98 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.278 -0.419 . . . . 73.34 110.924 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 2.9 p -178.85 38.01 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.264 -0.425 . . . . 62.43 110.852 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 1.9 t30 63.2 97.38 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.158 -0.474 . . . . 72.13 110.901 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 12.6 t -143.6 -179.85 6.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.143 -0.48 . . . . 71.41 110.832 -179.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 7.1 ptp85 -134.23 -170.04 2.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.16 -0.473 . . . . 75.43 110.919 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 5.2 ttpt -146.76 76.35 1.43 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 72.11 110.94 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 116.217 -0.447 . . . . 74.13 110.93 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 302' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' -2' ' ' LEU . . . . . . . . . . . . . 2.4 mp . . . . . 0 C--O 1.231 0.122 0 CA-C-O 121.584 0.707 . . . . 73.02 110.924 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' -1' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.71 155.68 65.46 Favored 'Trans proline' 0 C--O 1.233 0.262 0 C-N-CA 122.645 2.23 . . . . 73.21 112.381 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 0' ' ' LEU . . . . . 0.472 ' CB ' ' CD ' ' A' ' 1' ' ' PRO . 0.3 OUTLIER 179.8 -61.04 0.0 OUTLIER Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.612 0.72 . . . . 75.23 110.885 179.988 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . 0.472 ' CD ' ' CB ' ' A' ' 0' ' ' LEU . 54.0 Cg_endo -69.72 171.15 14.94 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.754 2.303 . . . . 64.24 112.348 179.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -158.55 36.91 0.23 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.229 -0.441 . . . . 62.24 110.954 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -67.38 -23.36 65.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.192 -0.458 . . . . 74.01 110.861 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.36 -34.0 66.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.175 -0.466 . . . . 71.4 111.127 179.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -58.32 -21.55 48.14 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.701 -0.761 . . . . 62.21 112.474 -179.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -108.93 21.51 27.28 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.688 -0.767 . . . . 54.42 112.463 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 31.1 mtt -75.23 164.19 26.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.814 0.34 . . . . 72.23 110.879 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -83.88 168.6 15.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.216 -0.447 . . . . 73.24 110.863 -179.854 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -62.44 -32.03 72.83 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.082 -0.508 . . . . 73.44 110.944 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.96 -42.82 80.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.156 -0.475 . . . . 72.33 110.887 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.41 -39.18 78.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.167 -0.47 . . . . 72.14 110.886 179.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 22.1 t-105 -72.04 -40.38 68.43 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.23 -0.441 . . . . 71.22 110.912 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 71.6 tt0 -73.12 -36.95 66.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.264 -0.425 . . . . 72.51 110.932 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -65.0 -38.42 90.9 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 74.32 110.909 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.27 -39.05 74.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.13 -0.486 . . . . 74.22 111.116 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -69.74 -43.0 73.21 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.174 -0.466 . . . . 73.12 110.905 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -66.42 -31.36 72.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.2 -0.454 . . . . 72.4 110.846 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -61.22 -36.27 79.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.168 -0.469 . . . . 75.11 110.934 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -71.88 -21.02 61.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.06 -0.518 . . . . 75.43 110.868 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 4.2 ptmt -75.06 -28.84 60.52 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.235 -0.438 . . . . 75.45 110.841 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.7 ptp180 -86.35 -28.11 23.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.295 -0.412 . . . . 74.22 110.851 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -65.05 -18.15 65.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.18 -0.464 . . . . 75.2 110.895 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -120.59 50.47 1.32 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.169 -0.469 . . . . 74.4 110.869 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.0 mt 67.64 -169.05 0.19 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.144 -0.48 . . . . 75.43 110.929 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -100.71 92.06 4.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.178 -0.464 . . . . 71.41 110.897 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -117.09 94.82 4.72 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.154 -0.475 . . . . 74.25 110.809 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.5 p -85.0 -17.55 37.21 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.148 -0.478 . . . . 62.15 110.883 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -58.49 -23.33 57.61 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.139 -0.482 . . . . 74.51 110.866 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.0 m -88.76 9.44 24.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.169 -0.469 . . . . 72.53 111.153 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 4.5 ttmm -58.66 115.84 3.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.202 -0.454 . . . . 74.12 110.907 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -178.93 152.55 0.59 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.185 -0.461 . . . . 74.52 110.843 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.15 -40.17 59.84 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.12 -0.491 . . . . 71.02 111.061 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -84.15 -18.66 35.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.243 -0.435 . . . . 71.33 110.898 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.4 m -59.99 -20.16 56.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.175 -0.466 . . . . 74.02 110.901 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.426 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 2.1 pp -57.91 -38.79 76.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.114 -0.494 . . . . 74.54 110.964 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.87 -53.13 61.64 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.198 -0.455 . . . . 73.13 110.981 179.874 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -66.05 -36.89 84.44 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.091 -0.504 . . . . 71.12 111.062 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.466 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.2 OUTLIER -65.34 -49.34 69.76 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.262 -0.426 . . . . 74.43 110.849 -179.969 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 35' ' ' LEU . 4.4 mt -63.64 -35.37 80.31 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.23 -0.441 . . . . 74.44 110.925 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 12.7 tmtt? -59.89 -45.83 91.27 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.19 -0.459 . . . . 74.2 110.877 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.466 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 3.2 pt-20 -60.91 -32.77 72.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.191 -0.459 . . . . 75.11 110.913 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 27.0 ttp -68.34 -34.1 75.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 63.43 110.954 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.418 ' HG3' ' HA ' ' A' ' 51' ' ' THR . 1.8 mm-40 -59.79 -39.59 85.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 75.32 110.878 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.6 mmpt? -70.56 -30.61 67.38 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.242 -0.436 . . . . 75.11 110.815 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 14.5 t80 -70.4 -42.22 71.95 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.255 -0.43 . . . . 73.32 110.893 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -82.19 -35.19 28.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.137 -0.483 . . . . 70.43 110.881 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 102.45 -7.81 54.32 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.777 -0.725 . . . . 64.42 112.479 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.07 138.34 91.13 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-O 121.649 0.737 . . . . 74.31 110.869 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.82 -52.12 0.34 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.677 2.252 . . . . 74.5 112.329 179.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -52.08 108.26 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.202 -0.454 . . . . 72.24 111.161 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.418 ' HA ' ' HG3' ' A' ' 43' ' ' GLN . 6.8 p -101.86 159.09 15.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.135 -0.484 . . . . 73.25 111.166 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 58.44 18.63 37.54 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.734 -0.746 . . . . 64.24 112.484 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 27.8 mmt -103.98 160.98 14.37 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.803 0.335 . . . . 75.23 110.899 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.403 ' HA ' ' HB ' ' A' ' 58' ' ' VAL . 25.8 tp -173.69 86.17 0.05 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.271 -0.422 . . . . 74.32 110.952 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.0 p30 174.72 -28.3 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.141 -0.481 . . . . 61.31 110.862 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 25.5 m -94.44 -100.19 0.15 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.244 -0.435 . . . . 75.25 110.844 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 3.3 tpp85 -84.79 -29.06 25.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.122 -0.49 . . . . 74.13 110.887 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.403 ' HB ' ' HA ' ' A' ' 54' ' ' LEU . 61.5 t -65.72 -41.03 89.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.153 -0.476 . . . . 72.2 111.092 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -75.16 -31.61 24.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.244 -0.435 . . . . 75.2 111.195 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -59.52 -44.23 93.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 73.45 110.86 179.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.452 HG13 ' N ' ' A' ' 62' ' ' MET . 1.3 pp -62.92 -29.03 46.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.149 -0.478 . . . . 74.52 111.12 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' MET . . . . . 0.452 ' N ' HG13 ' A' ' 61' ' ' ILE . 3.6 mmt -69.01 -35.03 76.2 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.215 -0.448 . . . . 74.01 110.852 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -88.56 -26.31 22.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.207 -0.452 . . . . 45.15 110.874 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.3 136.27 38.0 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.556 0.693 . . . . 75.32 110.891 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 127.62 14.88 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.621 2.214 . . . . 72.11 112.401 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 5.5 ttm180 -115.02 -88.05 0.58 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.271 -0.422 . . . . 73.22 110.864 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -146.02 156.39 43.45 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.17 -0.468 . . . . 72.31 110.935 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.508 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -98.22 21.05 48.02 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.796 -0.716 . . . . 64.23 112.462 -179.822 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -109.79 135.32 20.44 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.627 0.727 . . . . 74.23 111.193 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -69.78 156.24 63.8 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.715 2.277 . . . . 63.44 112.381 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -105.84 6.28 31.46 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.26 -0.427 . . . . 74.45 110.867 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.22 129.72 67.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.197 -0.456 . . . . 73.52 111.053 -179.924 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -130.78 170.3 14.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.208 -0.451 . . . . 73.13 111.129 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -177.18 173.02 1.84 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.223 -0.444 . . . . 74.13 110.883 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 65.23 152.38 0.06 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.13 -0.486 . . . . 71.51 110.933 -179.792 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 66.82 134.77 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.154 -0.476 . . . . 74.2 110.862 -179.84 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -74.95 -6.47 49.43 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.199 -0.455 . . . . 70.34 110.939 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER 63.69 160.0 0.12 Allowed Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.699 0.761 . . . . 71.24 110.901 180.0 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.41 ' HG3' ' HA2' ' A' ' 163' ' ' GLY . 54.1 Cg_endo -69.69 179.43 3.66 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.681 2.254 . . . . 73.34 112.35 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -52.02 105.97 0.13 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.21 -0.45 . . . . 74.43 110.899 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 63.73 158.25 0.12 Allowed Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.64 0.733 . . . . 70.4 110.888 -179.807 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.69 -35.06 13.57 Favored 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.627 2.218 . . . . 72.25 112.351 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 26.2 mttp -92.68 165.47 12.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.229 -0.442 . . . . 72.53 110.891 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . 0.431 ' N ' ' HH ' ' A' ' 238' ' ' TYR . 54.5 m95 -48.66 127.7 14.0 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.191 -0.459 . . . . 73.31 110.981 179.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 15.1 t -115.23 -1.37 12.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.301 -0.409 . . . . 71.34 111.218 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 3.6 m -68.15 -175.94 0.66 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.18 -0.464 . . . . 73.12 110.829 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 2.8 mttt -92.8 -25.03 18.33 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.099 -0.501 . . . . 71.12 110.904 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -153.83 142.13 13.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.206 -0.452 . . . . 74.14 111.138 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 58.8 t -116.6 130.22 71.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 72.25 111.167 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 11.7 p -120.01 168.07 11.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.207 -0.452 . . . . 75.51 111.109 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 2.9 p90 -145.38 146.93 31.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.217 -0.447 . . . . 70.51 110.933 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -146.21 131.67 18.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.104 -0.498 . . . . 74.3 110.914 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 18.6 mm -74.99 127.2 36.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.138 -0.483 . . . . 72.4 111.096 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.516 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 6.5 t -86.38 -40.8 14.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.184 -0.462 . . . . 74.41 111.1 179.826 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 32.9 t -157.16 169.52 24.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.449 . . . . 64.24 110.852 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 11.9 p90 -127.45 155.09 44.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.143 -0.481 . . . . 74.1 110.973 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 3.9 t -95.03 141.26 28.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.116 -0.493 . . . . 75.33 111.16 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 3.6 ptm180 -52.62 -18.96 2.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.287 -0.415 . . . . 72.14 110.836 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.31 -37.75 88.07 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.252 -0.431 . . . . 74.13 110.778 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.3 mt -138.65 152.94 71.84 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.613 0.72 . . . . 72.52 110.925 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.69 151.12 69.41 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.788 2.325 . . . . 73.11 112.354 179.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 13.1 t-160 -51.27 -26.28 7.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.253 -0.43 . . . . 74.11 110.875 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 12.2 tt -77.53 -38.06 25.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.175 -0.466 . . . . 74.02 111.084 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 3.0 m -69.01 -40.33 78.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.202 -0.454 . . . . 54.24 111.131 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 93.5 t -72.16 -46.19 59.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.266 -0.424 . . . . 73.13 111.097 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.584 ' O ' HG21 ' A' ' 109' ' ' VAL . 45.6 t0 -59.35 -45.69 90.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.202 -0.453 . . . . 63.44 110.842 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -70.36 -33.53 71.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.186 -0.461 . . . . 75.02 110.815 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.578 ' HB3' ' HD2' ' A' ' 188' ' ' PHE . 0.0 OUTLIER -60.3 -49.09 78.99 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.246 -0.434 . . . . 75.05 110.888 -179.958 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.584 HG21 ' O ' ' A' ' 106' ' ' ASP . 1.5 m -55.62 -41.49 64.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.153 -0.476 . . . . 72.31 111.045 179.892 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.465 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 37.5 t -70.0 -33.76 72.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.183 -0.462 . . . . 72.14 110.819 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.92 -33.3 73.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.152 -0.476 . . . . 74.35 110.864 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -95.87 -40.28 9.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.225 -0.443 . . . . 74.32 111.092 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.24 -32.9 74.81 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.205 -0.452 . . . . 74.11 110.92 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 38.9 t30 -64.66 -35.51 81.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 75.15 110.846 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.49 -33.79 75.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.174 -0.466 . . . . 74.0 110.862 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 9.4 m95 -70.58 -52.47 21.36 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.186 -0.461 . . . . 75.23 110.904 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -60.24 -43.61 98.31 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.724 -0.751 . . . . 73.44 112.494 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.97 -19.06 60.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.714 0.292 . . . . 74.42 110.85 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.434 ' HG2' HG13 ' A' ' 231' ' ' ILE . 0.2 OUTLIER -96.29 13.4 27.72 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.235 -0.438 . . . . 75.55 110.886 179.952 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 8.6 pt -146.89 147.04 28.32 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.55 0.691 . . . . 71.34 111.2 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 5.72 1.59 Allowed 'Trans proline' 0 C--O 1.233 0.245 0 C-N-CA 122.655 2.236 . . . . 75.35 112.32 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.427 ' HB3' ' H ' ' A' ' 123' ' ' HIS . 10.9 mt -61.12 -160.96 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.2 -0.454 . . . . 73.22 110.894 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.427 ' H ' ' HB3' ' A' ' 122' ' ' LEU . 3.5 t-160 -150.67 123.18 8.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.228 -0.442 . . . . 74.12 110.803 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 11.1 m-30 -107.54 148.76 28.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.253 -0.43 . . . . 75.54 110.934 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.03 141.24 48.14 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.153 -0.476 . . . . 75.14 110.843 -179.884 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.8 139.71 35.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 74.04 110.841 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 19.1 m -102.91 133.43 46.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.228 -0.442 . . . . 50.13 111.046 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -146.68 -23.59 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.157 -0.474 . . . . 74.43 111.064 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -138.59 109.3 6.64 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.195 -0.457 . . . . 73.32 110.961 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 108.48 -159.37 14.27 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.727 -0.749 . . . . 62.11 112.496 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.75 155.4 18.15 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.734 0.302 . . . . 71.11 111.158 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -112.87 165.33 12.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.225 -0.443 . . . . 72.32 111.104 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -65.37 -60.31 3.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.25 -0.432 . . . . 75.41 110.85 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 19.3 mt -90.7 129.42 41.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.161 -0.472 . . . . 71.04 111.124 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' MET . . . . . 0.516 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 0.0 OUTLIER -107.85 122.97 47.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.136 -0.483 . . . . 72.43 110.869 179.882 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -105.64 95.73 4.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.239 -0.437 . . . . 70.04 111.132 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -130.96 166.62 22.6 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.73 -0.747 . . . . 63.34 112.542 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 60.3 m-85 -105.28 149.14 26.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.912 0.387 . . . . 74.01 110.848 -179.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . 173.89 167.23 0.2 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.116 -0.493 . . . . 71.21 111.105 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 33.3 mtt180 -104.19 173.39 6.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.217 -0.447 . . . . 72.34 110.871 -179.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -57.46 -15.3 16.41 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.681 -0.771 . . . . 74.24 112.475 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -100.91 14.17 32.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.85 0.357 . . . . 75.03 111.09 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 8.9 p80 -68.19 -33.35 74.28 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.249 -0.432 . . . . 73.45 110.881 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 147.28 47.13 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.765 -0.731 . . . . 60.43 112.491 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -158.82 149.57 20.04 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.763 0.316 . . . . 72.14 110.857 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' SER . . . . . 0.475 ' O ' ' CB ' ' A' ' 147' ' ' TYR . 49.0 p -63.73 99.12 0.21 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.224 -0.444 . . . . 64.54 110.888 -179.777 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' TYR . . . . . 0.475 ' CB ' ' O ' ' A' ' 146' ' ' SER . 0.2 OUTLIER 163.04 121.21 0.0 OUTLIER Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.704 0.764 . . . . 73.4 110.848 -179.874 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.74 138.47 37.95 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.705 2.27 . . . . 74.53 112.372 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 149' ' ' PHE . . . . . 0.485 ' C ' ' H ' ' A' ' 151' ' ' GLY . 7.6 p90 -53.84 -42.38 68.44 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.209 -0.451 . . . . 70.0 110.841 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 75.61 -21.93 0.29 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.184 -0.462 . . . . 72.24 110.927 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . 0.485 ' H ' ' C ' ' A' ' 149' ' ' PHE . . . 78.83 -159.49 45.89 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.678 -0.773 . . . . 75.42 112.515 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.67 142.41 48.26 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.711 2.274 . . . . 75.11 112.363 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . 0.437 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 104.34 -137.52 13.62 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.752 -0.737 . . . . 70.32 112.522 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 154' ' ' ASN . . . . . 0.437 ' C ' ' O ' ' A' ' 153' ' ' GLY . 3.4 p30 -34.86 141.32 0.06 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.944 0.402 . . . . 74.45 110.826 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 75.22 90.07 0.08 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.15 -0.477 . . . . 63.14 111.16 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . 0.466 HD12 HG13 ' A' ' 186' ' ' ILE . 0.0 OUTLIER -71.9 -59.35 2.79 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.162 -0.472 . . . . 75.02 110.914 179.953 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . 0.508 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -161.59 148.82 14.57 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.198 -0.455 . . . . 73.44 111.088 179.779 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 15.4 p-80 -103.47 124.38 48.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.194 -0.457 . . . . 74.34 110.862 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -110.58 159.41 17.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.225 -0.443 . . . . 74.42 111.083 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 14.2 m-85 -112.58 152.24 29.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.217 -0.447 . . . . 75.31 110.88 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -81.67 163.64 53.01 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.591 0.71 . . . . 71.14 111.113 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.81 79.28 0.97 Allowed 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.667 2.245 . . . . 74.44 112.354 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 163' ' ' GLY . . . . . 0.41 ' HA2' ' HG3' ' A' ' 79' ' ' PRO . . . -148.87 122.8 1.53 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.752 -0.737 . . . . 72.32 112.504 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 1.1 m 66.43 149.75 0.05 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.803 0.335 . . . . 73.1 111.138 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -52.76 -45.45 60.65 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.687 -0.768 . . . . 74.03 112.474 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 10.1 tt -64.25 -39.9 94.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.891 0.377 . . . . 75.02 110.993 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -78.79 170.49 54.77 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.788 -0.72 . . . . 43.43 112.439 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 80.46 22.86 61.62 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.765 -0.731 . . . . 74.31 112.457 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 85.5 m-20 -96.32 165.13 12.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.853 0.359 . . . . 63.41 110.886 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.44 130.9 55.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.196 -0.456 . . . . 74.21 111.08 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 25.0 m170 -125.05 158.74 33.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.224 -0.444 . . . . 72.53 110.861 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -140.87 137.73 33.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.252 -0.431 . . . . 71.44 110.884 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 173' ' ' ASP . . . . . 0.415 ' HB3' ' OE1' ' A' ' 176' ' ' GLU . 13.6 t0 -70.85 100.92 2.02 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.133 -0.485 . . . . 74.11 110.861 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.05 -11.45 39.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.173 -0.467 . . . . 74.45 110.903 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -78.79 -16.53 57.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.143 -0.48 . . . . 73.32 110.85 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 176' ' ' GLU . . . . . 0.415 ' OE1' ' HB3' ' A' ' 173' ' ' ASP . 1.4 mt-10 -90.53 -168.83 2.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.253 -0.431 . . . . 71.41 110.893 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 54.1 mtt85 -115.64 121.49 42.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.162 -0.472 . . . . 74.32 110.869 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 60.4 m95 -116.92 144.42 44.56 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.213 -0.449 . . . . 74.32 110.916 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 2.5 t -177.0 163.81 2.21 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.224 -0.444 . . . . 74.13 111.139 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -125.07 -70.0 0.77 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.194 -0.457 . . . . 61.52 110.845 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -67.74 -10.8 59.09 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.68 -0.772 . . . . 62.41 112.529 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 182' ' ' SER . . . . . 0.464 ' O ' ' C ' ' A' ' 183' ' ' SER . 0.3 OUTLIER -95.07 -24.54 16.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.914 0.388 . . . . 74.0 110.881 -179.723 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 183' ' ' SER . . . . . 0.464 ' C ' ' O ' ' A' ' 182' ' ' SER . 56.8 m 32.94 66.17 0.21 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.076 -0.511 . . . . 64.12 110.898 -179.79 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 6.4 tp -116.9 -33.61 4.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.162 -0.472 . . . . 74.43 110.885 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -128.91 -128.26 3.04 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.756 -0.735 . . . . 74.22 112.506 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 186' ' ' ILE . . . . . 0.466 HG13 HD12 ' A' ' 156' ' ' LEU . 4.6 mm -79.33 97.56 2.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.856 0.36 . . . . 73.22 111.178 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -54.75 121.17 7.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.177 -0.465 . . . . 71.31 110.91 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 188' ' ' PHE . . . . . 0.578 ' HD2' ' HB3' ' A' ' 108' ' ' LEU . 1.3 t80 -54.43 -33.16 58.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.145 -0.479 . . . . 75.45 110.867 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.15 -47.93 69.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.134 -0.484 . . . . 60.14 110.965 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 85.7 t80 -70.14 -38.09 75.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.142 -0.481 . . . . 74.22 110.962 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -72.68 -35.4 67.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.098 -0.501 . . . . 61.32 111.027 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 192' ' ' ALA . . . . . 0.449 ' O ' ' HB2' ' A' ' 196' ' ' LEU . . . -56.8 -44.88 82.38 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.277 -0.42 . . . . 52.32 111.143 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -58.87 -43.04 90.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 72.43 111.177 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 11.7 t-160 -72.88 -38.02 67.13 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.166 -0.47 . . . . 71.44 110.861 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -75.5 -47.44 27.02 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.15 -0.477 . . . . 71.01 111.104 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 196' ' ' LEU . . . . . 0.459 HD22 ' N ' ' A' ' 196' ' ' LEU . 4.6 mm? -63.19 -43.98 96.67 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.234 -0.439 . . . . 74.52 110.864 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -59.14 -28.7 64.43 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.714 -0.755 . . . . 62.43 112.425 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 198' ' ' HIS . . . . . . . . . . . . . 5.1 m-70 -65.69 -32.88 74.68 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.789 0.328 . . . . 75.21 110.817 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.57 -21.17 60.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.24 -0.436 . . . . 73.13 110.849 -179.768 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 200' ' ' LEU . . . . . 0.424 ' HA ' ' CD1' ' A' ' 84' ' ' TRP . 0.6 OUTLIER -88.72 2.3 53.61 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.131 -0.486 . . . . 75.12 110.916 179.946 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 84.12 -9.02 64.78 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.718 -0.753 . . . . 50.41 112.446 179.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 202' ' ' MET . . . . . . . . . . . . . 37.6 tpp -51.51 138.94 21.2 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.806 0.336 . . . . 71.04 110.855 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -105.12 159.06 15.8 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.744 -0.741 . . . . 64.44 112.53 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 16.0 m-70 -55.52 163.38 1.29 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.813 0.34 . . . . 74.32 110.838 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -123.61 147.81 47.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.184 -0.462 . . . . 72.42 110.834 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -88.14 -4.03 58.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.128 -0.487 . . . . 72.22 110.854 -179.81 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -70.99 138.58 85.06 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.626 0.727 . . . . 65.11 110.836 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 -8.96 24.91 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.626 2.217 . . . . 74.53 112.37 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -127.98 29.71 5.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.237 -0.438 . . . . 63.52 110.934 179.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 210' ' ' ALA . . . . . 0.451 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.37 145.86 26.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.201 -0.454 . . . . 64.4 111.059 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -67.73 -28.77 42.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.246 -0.434 . . . . 75.23 111.115 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.75 8.84 42.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.149 -0.478 . . . . 75.22 110.908 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 213' ' ' TYR . . . . . 0.401 ' CE2' ' HB ' ' A' ' 215' ' ' THR . 1.8 t80 -55.73 115.02 8.42 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.703 0.763 . . . . 73.43 110.925 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.67 -17.79 37.78 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.711 2.274 . . . . 63.01 112.389 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 215' ' ' THR . . . . . 0.401 ' HB ' ' CE2' ' A' ' 213' ' ' TYR . 0.2 OUTLIER -83.77 55.6 3.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.215 -0.448 . . . . 74.24 111.139 -179.946 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -85.11 122.78 29.81 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.206 -0.452 . . . . 74.42 110.942 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -147.87 -59.31 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.703 -0.761 . . . . 74.22 112.47 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 24.7 p-10 -51.7 170.38 0.05 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.924 0.392 . . . . 64.22 110.871 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . -50.89 157.24 2.45 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.732 -0.747 . . . . 73.55 112.531 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 220' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -75.19 153.67 86.31 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.604 0.716 . . . . 73.41 110.88 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -69.83 135.78 31.17 Favored 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.661 2.241 . . . . 74.21 112.355 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 11.3 mp0 -62.57 -38.87 91.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.259 -0.428 . . . . 75.43 110.868 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 87.1 m-20 -121.74 -34.93 3.3 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.237 -0.438 . . . . 70.33 110.937 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER 66.75 135.84 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.113 -0.494 . . . . 71.11 110.882 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.75 154.67 43.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 65.02 110.91 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . 0.406 HD12 ' HG2' ' A' ' 119' ' ' GLU . 12.0 mt -69.98 148.66 48.62 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.268 -0.424 . . . . 62.53 110.931 179.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 227' ' ' SER . . . . . 0.451 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 0.0 OUTLIER -86.65 155.43 20.41 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.154 -0.476 . . . . 74.21 110.861 -179.886 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 42.6 mt-30 -67.45 -66.09 0.6 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.109 -0.496 . . . . 74.54 110.98 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -55.74 -26.63 46.48 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.156 -0.474 . . . . 74.2 110.864 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -69.1 -50.66 46.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.141 -0.481 . . . . 74.23 110.881 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 231' ' ' ILE . . . . . 0.434 HG13 ' HG2' ' A' ' 119' ' ' GLU . 2.8 mm -70.43 -42.18 78.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.222 -0.445 . . . . 73.41 111.118 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.47 -32.34 64.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.22 -0.445 . . . . 73.32 110.904 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -64.55 -50.01 61.53 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.753 -0.737 . . . . 65.45 112.437 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 5.5 tt -73.19 -30.81 32.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.731 0.301 . . . . 74.41 111.089 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -66.38 -24.16 66.45 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.256 -0.429 . . . . 71.13 110.923 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 236' ' ' LYS . . . . . 0.449 ' HE2' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.1 -20.61 60.21 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.239 -0.437 . . . . 74.41 110.904 179.918 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 237' ' ' LEU . . . . . 0.449 ' HB2' ' HE2' ' A' ' 236' ' ' LYS . 9.8 tt -97.21 -31.38 12.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.217 -0.447 . . . . 75.41 110.935 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 238' ' ' TYR . . . . . 0.431 ' HH ' ' N ' ' A' ' 84' ' ' TRP . 26.4 m-85 -92.16 -35.02 14.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 54.42 110.901 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -136.94 -119.64 1.86 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.69 -0.767 . . . . 72.22 112.47 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 3.5 tttm -96.8 156.78 16.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.722 0.296 . . . . 75.42 110.916 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 11.1 ptt180 -92.08 -172.58 3.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.245 -0.434 . . . . 73.34 110.838 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -139.2 -179.75 6.05 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.196 -0.456 . . . . 62.43 110.864 -179.852 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 16.4 m120 -122.85 99.88 6.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.136 -0.484 . . . . 72.13 110.874 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -179.78 162.72 1.08 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.189 -0.459 . . . . 71.41 110.807 -179.852 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -160.32 174.6 13.93 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.114 -0.494 . . . . 75.43 110.899 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -130.75 -55.24 1.07 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.156 -0.474 . . . . 72.11 110.905 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.24 -0.436 . . . . 74.13 110.872 179.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 302' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' -2' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.095 0 CA-C-O 121.599 0.714 . . . . 73.02 110.933 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' -1' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.74 178.43 4.56 Favored 'Trans proline' 0 C--O 1.232 0.211 0 C-N-CA 122.694 2.263 . . . . 73.21 112.336 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -91.89 159.17 38.6 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-O 121.637 0.732 . . . . 75.23 110.953 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.77 -48.37 0.73 Allowed 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.729 2.286 . . . . 64.24 112.367 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -179.1 38.8 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.229 -0.441 . . . . 62.24 110.933 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -58.75 -26.32 63.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 74.01 110.922 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -59.74 -33.96 72.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.123 -0.49 . . . . 71.4 111.151 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -58.24 -38.4 89.95 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.76 -0.733 . . . . 62.21 112.465 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -109.03 21.58 26.93 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.75 -0.738 . . . . 54.42 112.494 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 5.7 mtt -61.31 161.03 9.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.823 0.344 . . . . 72.23 110.894 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 53.3 m -101.43 168.69 9.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.259 -0.428 . . . . 73.24 110.883 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -54.39 -33.23 58.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.136 -0.484 . . . . 73.44 110.852 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -68.36 -42.88 78.55 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.185 -0.461 . . . . 72.33 110.927 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.8 tp-100 -69.69 -39.63 76.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.189 -0.459 . . . . 72.14 110.893 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 70.0 t-105 -70.55 -41.49 72.41 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.202 -0.454 . . . . 71.22 110.872 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -72.2 -35.16 68.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.314 -0.403 . . . . 72.51 110.886 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -71.34 -36.51 71.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.113 -0.494 . . . . 74.32 110.946 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.82 -44.1 86.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.254 -0.43 . . . . 74.22 111.076 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.511 ' HG3' ' N ' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -73.79 -31.92 63.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.264 -0.425 . . . . 73.12 110.865 -179.92 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.511 ' N ' ' HG3' ' A' ' 16' ' ' GLN . 74.5 m-20 -77.72 -31.09 52.05 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.259 -0.428 . . . . 72.4 110.898 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -59.75 -36.32 76.4 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.175 -0.466 . . . . 75.11 110.902 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.24 -20.99 61.45 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.19 -0.459 . . . . 75.43 110.911 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 4.2 ptmt -74.0 -27.86 61.17 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.177 -0.465 . . . . 75.45 110.877 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.0 ptp180 -86.34 -27.73 24.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.23 -0.441 . . . . 74.22 110.804 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -60.16 -21.18 61.34 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.219 -0.446 . . . . 75.2 110.859 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -120.38 50.41 1.32 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.134 -0.484 . . . . 74.4 110.952 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.428 ' HG ' ' CG2' ' A' ' 72' ' ' VAL . 3.8 mt 68.64 -168.03 0.18 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.11 -0.496 . . . . 75.43 110.916 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -92.49 89.9 6.95 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.15 -0.477 . . . . 71.41 110.926 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -113.94 116.28 29.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.167 -0.47 . . . . 74.25 110.822 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 99.9 p -85.19 -6.39 59.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.235 -0.438 . . . . 62.15 110.885 -179.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.9 -15.36 58.85 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.125 -0.489 . . . . 74.51 110.895 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -80.87 0.86 33.29 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.133 -0.485 . . . . 72.53 111.098 -179.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.7 mptt -58.51 170.12 0.8 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.235 -0.439 . . . . 74.12 110.922 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 25.6 t30 65.55 156.78 0.09 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.285 -0.416 . . . . 74.52 110.861 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.69 -23.95 58.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.172 -0.467 . . . . 71.02 111.057 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -65.56 -18.8 65.59 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.226 -0.443 . . . . 71.33 110.888 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 52.8 m -85.58 -33.6 21.66 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.209 -0.451 . . . . 74.02 110.81 -179.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.8 mp -57.56 -44.89 85.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.163 -0.471 . . . . 74.54 110.952 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -61.8 -51.47 68.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.166 -0.47 . . . . 73.13 110.913 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -61.48 -50.51 72.47 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.116 -0.493 . . . . 71.12 111.138 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.83 -38.28 81.57 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.152 -0.476 . . . . 74.43 110.92 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.6 mp -61.63 -39.45 91.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.161 -0.472 . . . . 74.44 110.852 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 37.9 mttp -66.22 -46.71 76.25 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.205 -0.452 . . . . 74.2 110.935 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -70.57 -33.04 70.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.188 -0.46 . . . . 75.11 110.903 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.31 -47.5 70.38 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.164 -0.471 . . . . 63.43 110.884 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.523 ' HB3' ' HB2' ' A' ' 48' ' ' LEU . 31.4 mt-30 -59.0 -42.8 90.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.225 -0.443 . . . . 75.32 110.96 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.3 mmpt? -59.6 -27.76 66.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.223 -0.444 . . . . 75.11 110.874 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -70.56 -37.67 74.04 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.24 -0.436 . . . . 73.32 110.834 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 -83.94 9.52 12.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.171 -0.468 . . . . 70.43 110.879 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.439 ' HA2' ' HB3' ' A' ' 206' ' ' SER . . . 76.55 11.81 84.89 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.782 -0.723 . . . . 64.42 112.474 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.523 ' HB2' ' HB3' ' A' ' 43' ' ' GLN . 6.1 mt -76.4 121.73 85.44 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.56 0.695 . . . . 74.31 110.952 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.83 -44.77 1.84 Allowed 'Trans proline' 0 C--O 1.231 0.16 0 C-N-CA 122.643 2.229 . . . . 74.5 112.35 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 13.1 pt -58.87 129.67 21.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.193 -0.458 . . . . 72.24 111.144 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 76.5 p -115.2 128.88 56.45 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.127 -0.488 . . . . 73.25 111.179 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 90.95 30.03 11.93 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.746 -0.74 . . . . 64.24 112.45 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.6 mmt -130.98 133.91 46.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.873 0.368 . . . . 75.23 110.845 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.438 ' HA ' ' HB ' ' A' ' 58' ' ' VAL . 17.3 tp -154.13 95.94 1.89 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.114 -0.493 . . . . 74.32 110.946 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 171.01 -26.48 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.198 -0.455 . . . . 61.31 110.93 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 18.6 m -89.38 -99.62 0.09 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.118 -0.492 . . . . 75.25 110.855 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 12.2 tpt85 -84.53 -27.42 27.37 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.199 -0.455 . . . . 74.13 110.905 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.438 ' HB ' ' HA ' ' A' ' 54' ' ' LEU . 24.8 t -58.06 -44.31 86.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.143 -0.48 . . . . 72.2 111.119 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 9.9 mm -74.55 -30.89 26.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.147 -0.479 . . . . 75.2 111.219 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -59.2 -35.04 72.89 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.119 -0.491 . . . . 73.45 110.892 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -76.12 -29.18 19.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.194 -0.457 . . . . 74.52 111.13 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 7.0 mtt -61.76 -39.48 91.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.192 -0.458 . . . . 74.01 110.872 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -81.51 -22.73 37.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.22 -0.445 . . . . 45.15 110.873 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.1 mtmt -85.22 126.45 67.31 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.565 0.698 . . . . 75.32 110.95 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.66 140.1 42.22 Favored 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.72 2.28 . . . . 72.11 112.368 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -134.87 -77.72 0.45 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.254 -0.43 . . . . 73.22 110.901 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -145.26 148.81 33.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.469 . . . . 72.31 110.926 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.558 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -106.46 28.31 13.94 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.678 -0.773 . . . . 64.23 112.52 -179.909 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -106.12 134.26 19.84 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 121.622 0.725 . . . . 74.23 111.135 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.7 132.69 23.96 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.706 2.27 . . . . 63.44 112.326 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -93.29 22.16 5.42 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.245 -0.434 . . . . 74.45 110.887 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.428 ' CG2' ' HG ' ' A' ' 24' ' ' LEU . 3.1 m -136.85 129.9 45.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.154 -0.475 . . . . 73.52 111.124 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -130.87 170.29 14.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.168 -0.469 . . . . 73.13 111.064 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 178.48 94.3 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.184 -0.462 . . . . 74.13 110.881 -179.95 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -160.62 163.85 32.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.184 -0.462 . . . . 71.51 110.908 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -111.65 175.31 5.48 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.058 -0.519 . . . . 74.2 110.871 -179.872 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 9.7 mt 62.55 16.94 9.19 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.167 -0.47 . . . . 70.34 110.923 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 15.7 p90 -57.17 156.71 13.62 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.599 0.714 . . . . 71.24 110.884 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.7 171.85 13.64 Favored 'Trans proline' 0 C--N 1.341 0.145 0 C-N-CA 122.716 2.277 . . . . 73.34 112.32 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -54.44 100.73 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.205 -0.452 . . . . 74.43 110.851 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 63.05 158.77 0.12 Allowed Pre-proline 0 C--N 1.33 -0.266 0 CA-C-O 121.621 0.724 . . . . 70.4 110.903 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.74 -10.81 29.49 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.696 2.264 . . . . 72.25 112.334 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.414 ' HD2' ' CD2' ' A' ' 237' ' ' LEU . 9.4 mttt -106.56 171.0 7.59 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.189 -0.46 . . . . 72.53 110.954 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 61.0 m95 -56.53 131.15 47.85 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.239 -0.437 . . . . 73.31 110.933 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 4.8 t -115.19 -16.34 11.56 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.172 -0.467 . . . . 71.34 111.089 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 3.3 m -59.06 172.89 0.51 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.247 -0.433 . . . . 73.12 110.887 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 2.8 mptp? -85.04 -21.17 29.51 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.124 -0.489 . . . . 71.12 110.931 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -154.8 143.57 13.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.197 -0.456 . . . . 74.14 111.111 179.836 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 25.7 t -119.64 130.44 74.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.167 -0.47 . . . . 72.25 111.171 179.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 43.5 p -115.77 163.53 15.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.471 . . . . 75.51 111.1 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 4.7 p90 -145.96 146.22 30.95 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.207 -0.451 . . . . 70.51 110.923 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 3.7 ttt-85 -151.69 139.09 19.46 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.131 -0.486 . . . . 74.3 110.849 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 11.1 mm -74.84 131.28 35.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.162 -0.472 . . . . 72.4 111.141 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.44 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 9.3 t -88.6 -40.74 13.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.461 . . . . 74.41 111.183 179.812 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -151.52 169.36 22.27 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.128 -0.487 . . . . 64.24 110.792 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 13.8 p90 -129.63 155.08 46.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.11 -0.496 . . . . 74.1 110.98 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 2.1 t -102.79 141.84 34.92 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.183 -0.462 . . . . 75.33 111.194 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.44 -18.72 1.78 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.27 -0.423 . . . . 72.14 110.866 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -65.16 -37.32 87.0 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.158 -0.474 . . . . 74.13 110.847 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.3 mp -142.37 152.82 61.62 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.681 0.753 . . . . 72.52 110.858 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . 0.413 ' HB2' HG21 ' A' ' 103' ' ' ILE . 53.4 Cg_endo -69.76 150.97 68.92 Favored 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 122.689 2.259 . . . . 73.11 112.337 179.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 3.7 t-160 -52.7 -25.62 11.53 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.225 -0.443 . . . . 74.11 110.882 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.413 HG21 ' HB2' ' A' ' 101' ' ' PRO . 13.9 tt -77.36 -39.2 27.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.15 -0.477 . . . . 74.02 111.098 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 3.6 m -69.13 -36.21 77.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.18 -0.463 . . . . 54.24 111.181 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 60.2 t -71.93 -42.91 68.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.226 -0.443 . . . . 73.13 111.126 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.622 ' O ' HG22 ' A' ' 109' ' ' VAL . 0.0 OUTLIER -67.02 -37.19 83.69 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.171 -0.468 . . . . 63.44 110.845 179.92 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . 0.504 ' HG3' ' N ' ' A' ' 108' ' ' LEU . 0.0 OUTLIER -70.72 -33.27 70.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.172 -0.467 . . . . 75.02 110.891 -179.876 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.522 ' HB3' ' HD1' ' A' ' 188' ' ' PHE . 0.0 OUTLIER -66.44 -47.77 72.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.21 -0.45 . . . . 75.05 110.916 -179.978 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.622 HG22 ' O ' ' A' ' 106' ' ' ASP . 1.5 m -55.03 -42.99 67.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.146 -0.479 . . . . 72.31 111.091 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.493 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 30.2 t -70.62 -33.8 71.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.256 -0.429 . . . . 72.14 110.858 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.02 -33.11 73.76 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.17 -0.468 . . . . 74.35 110.913 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.7 -40.14 9.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.188 -0.46 . . . . 74.32 111.048 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.43 ' HB2' ' HG ' ' A' ' 196' ' ' LEU . 0.4 OUTLIER -64.73 -33.26 75.55 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.249 -0.432 . . . . 74.11 110.909 -179.997 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -66.38 -34.89 78.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.183 -0.462 . . . . 75.15 110.861 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.24 -33.33 71.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 74.0 110.843 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 6.3 m95 -70.16 -42.76 72.05 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.232 -0.44 . . . . 75.23 110.898 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -72.89 -40.81 51.21 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.735 -0.745 . . . . 73.44 112.43 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.3 ptpt -61.34 -14.52 27.75 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.802 0.334 . . . . 74.42 110.897 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.9 mm-40 -100.69 13.39 35.0 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.241 -0.436 . . . . 75.55 110.838 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.527 ' C ' ' H ' ' A' ' 122' ' ' LEU . 6.6 pt -147.99 144.55 19.12 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.635 0.731 . . . . 71.34 111.099 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.72 24.57 0.17 Allowed 'Trans proline' 0 C--O 1.232 0.221 0 C-N-CA 122.673 2.249 . . . . 75.35 112.367 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.527 ' H ' ' C ' ' A' ' 120' ' ' ILE . 6.3 mt -77.46 -159.71 0.15 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.167 -0.47 . . . . 73.22 110.902 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.458 ' H ' ' HB3' ' A' ' 122' ' ' LEU . 3.4 t-160 -151.19 120.98 7.03 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.184 -0.462 . . . . 74.12 110.934 179.852 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 11.0 m-30 -110.36 148.44 31.97 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.224 -0.443 . . . . 75.54 110.891 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.91 141.35 50.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.125 -0.489 . . . . 75.14 110.853 -179.872 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.14 145.25 31.13 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.247 -0.433 . . . . 74.04 110.875 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 30.4 m -103.3 126.58 57.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.248 -0.433 . . . . 50.13 111.097 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -142.07 -22.62 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.116 -0.493 . . . . 74.43 111.187 179.859 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -140.72 109.15 5.86 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.104 -0.498 . . . . 73.32 110.92 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.07 -162.24 13.53 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.747 -0.74 . . . . 62.11 112.521 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 3.2 m -101.79 156.61 17.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.79 0.329 . . . . 71.11 111.13 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -111.22 165.2 12.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.218 -0.446 . . . . 72.32 111.136 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -69.05 -55.33 11.13 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.188 -0.46 . . . . 75.41 110.883 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 41.1 mt -82.7 131.06 34.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.196 -0.456 . . . . 71.04 111.12 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' MET . . . . . 0.44 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 27.2 mmt -108.06 118.37 36.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.162 -0.472 . . . . 72.43 110.964 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -106.16 89.87 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.316 -0.402 . . . . 70.04 111.166 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -129.53 169.45 20.73 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.774 -0.726 . . . . 63.34 112.509 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' PHE . . . . . 0.425 ' O ' ' CB ' ' A' ' 139' ' ' ALA . 45.5 m-85 -106.04 147.04 29.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.888 0.375 . . . . 74.01 110.945 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.425 ' CB ' ' O ' ' A' ' 138' ' ' PHE . . . 167.48 166.19 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.142 -0.481 . . . . 71.21 111.105 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.408 ' HB2' ' HB3' ' A' ' 149' ' ' PHE . 1.0 OUTLIER -109.28 174.36 5.9 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.216 -0.447 . . . . 72.34 110.832 -179.939 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . 0.474 ' H ' ' HA ' ' A' ' 149' ' ' PHE . . . -54.13 -17.68 8.07 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.783 -0.722 . . . . 74.24 112.461 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -89.36 13.29 13.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.848 0.356 . . . . 75.03 111.159 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 5.0 p80 -81.09 0.91 33.96 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.191 -0.458 . . . . 73.45 110.859 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 104.61 47.1 1.23 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.828 -0.701 . . . . 60.43 112.521 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -159.46 174.21 15.03 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.795 0.331 . . . . 72.14 110.885 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 57.7 m -63.98 176.42 0.97 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.227 -0.442 . . . . 64.54 110.848 -179.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 64.91 121.39 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.599 0.714 . . . . 73.4 110.908 -179.913 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.82 151.29 68.67 Favored 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.627 2.218 . . . . 74.53 112.335 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 149' ' ' PHE . . . . . 0.518 ' O ' ' CG ' ' A' ' 150' ' ' ASP . 1.5 p90 -53.93 -30.22 45.51 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.192 -0.458 . . . . 70.0 110.931 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . 0.518 ' CG ' ' O ' ' A' ' 149' ' ' PHE . 2.9 p30 50.03 15.45 0.18 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.135 -0.484 . . . . 72.24 110.851 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . 0.407 ' C ' ' O ' ' A' ' 150' ' ' ASP . . . 37.5 -154.64 0.01 OUTLIER Glycine 0 N--CA 1.453 -0.228 0 C-N-CA 120.698 -0.763 . . . . 75.42 112.518 -179.925 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 143.51 51.25 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.627 2.218 . . . . 75.11 112.389 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . 0.448 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 105.0 -132.14 10.96 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.809 -0.71 . . . . 70.32 112.493 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 154' ' ' ASN . . . . . 0.448 ' C ' ' O ' ' A' ' 153' ' ' GLY . 2.7 p30 -34.62 142.51 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.954 0.407 . . . . 74.45 110.907 -179.925 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 69.59 110.06 0.05 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.21 -0.45 . . . . 63.14 111.16 -179.921 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . 0.49 HD11 HG13 ' A' ' 186' ' ' ILE . 0.6 OUTLIER -87.97 -54.5 4.2 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.15 -0.477 . . . . 75.02 110.947 179.965 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . 0.558 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -163.84 149.18 10.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.209 -0.451 . . . . 73.44 111.092 179.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 33.9 p-80 -108.1 123.36 48.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.2 -0.455 . . . . 74.34 110.771 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -111.05 160.23 17.04 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.154 -0.475 . . . . 74.42 111.152 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -110.89 150.77 28.71 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.285 -0.416 . . . . 75.31 110.892 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -79.26 162.1 65.27 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.607 0.718 . . . . 71.14 111.116 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.74 77.82 1.04 Allowed 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.704 2.269 . . . . 74.44 112.315 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -135.18 121.5 2.59 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.697 -0.763 . . . . 72.32 112.52 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 62.61 -173.64 0.15 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.817 0.342 . . . . 73.1 111.144 -179.825 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -79.09 -49.79 6.17 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.815 -0.707 . . . . 74.03 112.527 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 6.1 tt -63.78 -37.17 86.37 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.863 0.363 . . . . 75.02 110.874 -179.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -79.18 157.5 42.97 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.725 -0.75 . . . . 43.43 112.454 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 94.42 22.9 23.22 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.719 -0.753 . . . . 74.31 112.542 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 80.6 m-20 -94.4 168.49 10.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.877 0.37 . . . . 63.41 110.789 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -117.11 130.83 56.89 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.124 -0.489 . . . . 74.21 111.042 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 28.1 m170 -126.11 132.14 51.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.2 -0.454 . . . . 72.53 110.85 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 172' ' ' PHE . . . . . 0.413 ' HA ' ' HB3' ' A' ' 157' ' ' ALA . 32.3 m-85 -113.75 139.97 48.66 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.214 -0.448 . . . . 71.44 110.876 -179.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 55.3 t0 -71.56 100.25 2.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.112 -0.494 . . . . 74.11 110.831 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.62 -16.53 10.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.227 -0.442 . . . . 74.45 110.823 -179.87 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -78.46 -16.19 57.81 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.208 -0.451 . . . . 73.32 110.806 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -83.59 -174.54 5.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.255 -0.43 . . . . 71.41 110.969 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 12.9 mtm180 -113.23 116.95 30.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.207 -0.451 . . . . 74.32 110.907 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 44.2 m95 -116.86 137.44 52.21 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.235 -0.439 . . . . 74.32 110.897 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 5.0 t -176.58 163.69 2.42 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.219 -0.446 . . . . 74.13 111.143 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -123.99 -68.69 0.85 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.204 -0.453 . . . . 61.52 110.842 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -66.8 -10.84 56.46 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.755 -0.736 . . . . 62.41 112.492 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 182' ' ' SER . . . . . 0.448 ' O ' ' C ' ' A' ' 183' ' ' SER . 0.3 OUTLIER -96.59 -24.32 16.09 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.912 0.387 . . . . 74.0 110.915 -179.781 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 183' ' ' SER . . . . . 0.448 ' C ' ' O ' ' A' ' 182' ' ' SER . 97.4 p 34.02 63.3 0.41 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.131 -0.486 . . . . 64.12 110.825 -179.9 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 24.8 tp -116.91 -33.64 4.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.18 -0.464 . . . . 74.43 110.889 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -124.51 -135.76 4.49 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.699 -0.762 . . . . 74.22 112.484 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 186' ' ' ILE . . . . . 0.49 HG13 HD11 ' A' ' 156' ' ' LEU . 7.1 mm -79.36 100.09 3.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.775 0.322 . . . . 73.22 111.162 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -50.75 123.79 9.72 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.131 -0.486 . . . . 71.31 110.816 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 188' ' ' PHE . . . . . 0.522 ' HD1' ' HB3' ' A' ' 108' ' ' LEU . 1.6 t80 -54.03 -35.42 61.94 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.121 -0.49 . . . . 75.45 110.873 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.27 -47.11 71.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.122 -0.49 . . . . 60.14 110.955 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.16 -40.86 77.92 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.234 -0.439 . . . . 74.22 110.934 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -70.16 -35.05 73.73 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.128 -0.487 . . . . 61.32 111.079 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 192' ' ' ALA . . . . . 0.47 ' HB1' HD23 ' A' ' 196' ' ' LEU . . . -56.81 -43.24 80.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.216 -0.447 . . . . 52.32 111.102 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -57.86 -42.63 84.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.21 -0.45 . . . . 72.43 111.117 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 5.7 t-160 -73.46 -40.23 64.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.182 -0.463 . . . . 71.44 110.905 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -70.69 -48.85 52.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.139 -0.482 . . . . 71.01 111.059 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 196' ' ' LEU . . . . . 0.47 HD23 ' HB1' ' A' ' 192' ' ' ALA . 4.2 mm? -64.04 -46.6 83.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 74.52 110.939 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -55.06 -31.97 56.36 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.74 -0.743 . . . . 62.43 112.429 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 198' ' ' HIS . . . . . . . . . . . . . 4.5 m-70 -65.54 -36.42 83.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.855 0.36 . . . . 75.21 110.826 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 29.9 t -67.38 -21.05 65.63 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.187 -0.46 . . . . 73.13 110.871 -179.755 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -90.31 -0.07 57.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.141 -0.482 . . . . 75.12 110.935 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 85.01 -7.89 72.83 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.692 -0.766 . . . . 50.41 112.449 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 202' ' ' MET . . . . . . . . . . . . . 28.3 tpp -50.05 139.36 14.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.797 0.332 . . . . 71.04 110.966 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -101.17 159.08 18.85 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.776 -0.726 . . . . 64.44 112.535 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 22.5 m-70 -56.99 154.81 9.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.791 0.329 . . . . 74.32 110.851 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -119.3 145.05 46.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.234 -0.439 . . . . 72.42 110.852 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 206' ' ' SER . . . . . 0.439 ' HB3' ' HA2' ' A' ' 47' ' ' GLY . 1.7 m -87.97 -4.26 58.83 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.155 -0.475 . . . . 72.22 110.805 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -71.38 137.7 83.85 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.635 0.731 . . . . 65.11 110.835 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -69.71 -9.84 27.11 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.704 2.269 . . . . 74.53 112.368 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 -122.01 24.72 9.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.145 -0.479 . . . . 63.52 110.858 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 210' ' ' ALA . . . . . 0.424 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.33 145.17 26.44 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.185 -0.461 . . . . 64.4 111.092 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -69.5 -27.71 35.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.185 -0.461 . . . . 75.23 111.163 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -92.1 3.65 54.83 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.205 -0.452 . . . . 75.22 110.841 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 213' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -55.54 110.43 2.25 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-O 121.652 0.739 . . . . 73.43 110.934 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 -18.07 37.17 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.685 2.257 . . . . 63.01 112.31 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -84.11 58.1 4.57 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.247 -0.433 . . . . 74.24 111.136 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -51.48 128.32 22.53 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.246 -0.434 . . . . 74.42 110.907 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . 147.19 52.13 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.759 -0.734 . . . . 74.22 112.489 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 7.5 p30 -122.83 -177.61 3.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.827 0.346 . . . . 64.22 110.921 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . -51.85 157.16 3.4 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.742 -0.742 . . . . 73.55 112.498 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 220' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -102.58 101.44 20.27 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-O 121.589 0.709 . . . . 73.41 110.883 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.81 168.56 21.27 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.7 2.266 . . . . 74.21 112.326 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -75.12 -44.91 44.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.236 -0.438 . . . . 75.43 110.954 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -126.77 -39.99 1.94 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.176 -0.465 . . . . 70.33 110.952 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER 66.08 137.59 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.162 -0.472 . . . . 71.11 110.922 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -143.23 -167.74 2.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.109 -0.496 . . . . 65.02 110.905 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.3 148.67 31.32 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.208 -0.451 . . . . 62.53 110.902 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 227' ' ' SER . . . . . 0.424 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 2.0 t -87.12 157.4 19.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.192 -0.458 . . . . 74.21 110.926 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -63.44 -63.07 1.28 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.12 -0.491 . . . . 74.54 110.871 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -55.74 -27.77 52.4 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.212 -0.449 . . . . 74.2 110.897 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.22 -48.51 61.76 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.275 -0.42 . . . . 74.23 110.805 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 231' ' ' ILE . . . . . . . . . . . . . 8.3 mt -68.23 -43.07 84.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.213 -0.449 . . . . 73.41 111.1 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 11.8 pttp -66.09 -33.03 74.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.157 -0.474 . . . . 73.32 110.91 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -63.18 -46.78 92.41 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.784 -0.722 . . . . 65.45 112.435 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 7.0 tt -72.9 -30.77 33.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.74 0.305 . . . . 74.41 111.066 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -65.87 -24.3 66.84 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.214 -0.448 . . . . 71.13 110.862 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 236' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.64 -28.29 60.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.259 -0.428 . . . . 74.41 110.913 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 237' ' ' LEU . . . . . 0.414 ' CD2' ' HD2' ' A' ' 83' ' ' LYS . 7.0 tt -97.77 -31.0 12.46 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.2 -0.455 . . . . 75.41 110.892 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 238' ' ' TYR . . . . . 0.413 ' CE2' ' HG ' ' A' ' 122' ' ' LEU . 3.7 m-85 -91.85 -35.21 14.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.19 -0.459 . . . . 54.42 110.875 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -127.41 -120.17 2.31 Favored Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.691 -0.766 . . . . 72.22 112.453 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 2.0 mttm -98.07 144.91 27.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.842 0.353 . . . . 75.42 110.841 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.57 168.95 11.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.231 -0.441 . . . . 73.34 110.926 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -140.48 -43.12 0.41 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.28 -0.418 . . . . 62.43 110.868 -179.845 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -165.6 123.23 1.51 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.184 -0.462 . . . . 72.13 110.886 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -54.23 172.59 0.09 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.13 -0.486 . . . . 71.41 110.879 -179.812 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -164.89 163.02 21.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.155 -0.475 . . . . 75.43 110.881 -179.862 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.76 163.07 20.42 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.197 -0.456 . . . . 72.11 110.892 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 1.5 ptpt . . . . . 0 C--N 1.33 -0.267 0 CA-C-N 116.167 -0.47 . . . . 74.13 110.827 179.902 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 302' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' -2' ' ' LEU . . . . . 0.478 ' N ' ' HD2' ' A' ' -1' ' ' PRO . 2.3 mt . . . . . 0 C--O 1.232 0.136 0 CA-C-O 121.594 0.711 . . . . 73.02 110.889 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' -1' ' ' PRO . . . . . 0.478 ' HD2' ' N ' ' A' ' -2' ' ' LEU . 53.0 Cg_endo -69.87 96.11 0.59 Allowed 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.635 2.224 . . . . 73.21 112.288 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 0' ' ' LEU . . . . . 0.476 ' N ' ' HD2' ' A' ' 1' ' ' PRO . 0.3 OUTLIER -68.58 -60.43 4.72 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.587 0.708 . . . . 75.23 110.888 179.972 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . 0.476 ' HD2' ' N ' ' A' ' 0' ' ' LEU . 53.4 Cg_endo -69.75 -176.39 1.47 Allowed 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.694 2.263 . . . . 64.24 112.31 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -113.98 130.31 56.54 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.236 -0.438 . . . . 62.24 110.926 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -95.12 -25.27 16.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.142 -0.481 . . . . 74.01 110.891 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.58 -34.05 66.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.142 -0.481 . . . . 71.4 111.094 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -55.76 -37.98 71.23 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.746 -0.74 . . . . 62.21 112.532 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -108.94 20.89 28.35 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.754 -0.736 . . . . 54.42 112.475 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 7.5 mtt -82.9 161.32 21.9 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.771 0.32 . . . . 72.23 110.908 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.3 p -115.57 168.65 9.82 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.25 -0.432 . . . . 73.24 110.819 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -54.36 -31.87 55.59 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.103 -0.498 . . . . 73.44 110.916 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.79 -42.74 97.69 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.151 -0.477 . . . . 72.33 110.862 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -63.02 -42.2 99.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.231 -0.44 . . . . 72.14 110.925 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 3.4 t-105 -72.94 -37.16 67.25 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.159 -0.473 . . . . 71.22 110.917 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 41.1 mm-40 -71.17 -35.49 71.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.271 -0.422 . . . . 72.51 110.926 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 5.8 mm-40 -68.85 -37.13 78.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.098 -0.501 . . . . 74.32 110.88 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.21 -36.95 71.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.2 -0.454 . . . . 74.22 111.059 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 10.6 tt0 -69.87 -42.96 72.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.21 -0.45 . . . . 73.12 110.931 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 35.6 m-20 -65.21 -31.56 72.79 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.46 . . . . 72.4 110.808 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 17.5 m-85 -70.42 -36.6 74.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.214 -0.448 . . . . 75.11 110.979 -179.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -72.01 -26.32 62.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.063 -0.517 . . . . 75.43 110.923 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 5.0 ptmt -67.6 -32.18 72.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.175 -0.466 . . . . 75.45 110.882 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.8 ptp85 -85.91 -26.74 25.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.251 -0.432 . . . . 74.22 110.82 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -74.51 2.36 9.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.255 -0.429 . . . . 75.2 110.868 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 60.3 t80 -118.26 -75.93 0.58 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.154 -0.475 . . . . 74.4 110.947 -179.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 95.1 mt -156.7 22.11 0.33 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.067 -0.515 . . . . 75.43 110.912 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 4.3 t80 49.48 89.69 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.277 -0.42 . . . . 71.41 110.945 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -125.25 115.28 20.13 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.051 -0.522 . . . . 74.25 110.842 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 58.5 p -83.58 -6.56 59.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.261 -0.427 . . . . 62.15 110.845 -179.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -91.69 -22.58 20.16 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.186 -0.461 . . . . 74.51 110.908 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 11.7 m -76.92 -18.77 58.07 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.124 -0.489 . . . . 72.53 111.143 -179.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.29 100.65 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.24 -0.436 . . . . 74.12 110.898 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -179.23 155.15 0.7 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 74.52 110.887 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.98 -33.87 70.85 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.179 -0.464 . . . . 71.02 111.128 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 16.4 m-20 -67.85 -40.19 83.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.161 -0.472 . . . . 71.33 110.897 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 5.1 m -86.12 -20.09 29.2 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.149 -0.478 . . . . 74.02 110.881 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.423 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 31.1 tp -58.01 -45.19 87.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.089 -0.505 . . . . 74.54 110.861 -179.946 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -57.64 -46.06 84.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.295 -0.412 . . . . 73.13 110.821 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.56 -36.68 84.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.133 -0.485 . . . . 71.12 111.108 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 11.8 mtmt -70.38 -49.31 50.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.171 -0.468 . . . . 74.43 110.845 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.423 ' HG ' ' O ' ' A' ' 35' ' ' LEU . 5.1 mt -59.79 -35.77 75.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.287 -0.415 . . . . 74.44 110.881 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.1 ttmt -58.15 -46.25 85.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.198 -0.455 . . . . 74.2 110.912 179.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -70.37 -36.4 74.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 75.11 110.869 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.9 ttp -69.4 -36.48 76.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.173 -0.467 . . . . 63.43 110.849 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -66.91 -43.34 83.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.166 -0.47 . . . . 75.32 110.987 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.547 ' HD2' ' N ' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -73.11 -20.83 60.85 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.191 -0.459 . . . . 75.11 110.921 179.886 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.547 ' N ' ' HD2' ' A' ' 44' ' ' LYS . 89.1 t80 -71.22 -37.6 72.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.241 -0.436 . . . . 73.32 110.945 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -81.91 -28.4 32.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.109 -0.496 . . . . 70.43 110.841 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 106.45 -10.44 42.48 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.723 -0.751 . . . . 64.42 112.538 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.401 HD13 HG13 ' A' ' 50' ' ' ILE . 0.9 OUTLIER -63.47 138.61 97.41 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.65 0.738 . . . . 74.31 110.863 -179.858 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.84 -54.04 0.24 Allowed 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.664 2.243 . . . . 74.5 112.38 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.401 HG13 HD13 ' A' ' 48' ' ' LEU . 0.7 OUTLIER -50.08 107.97 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.24 -0.436 . . . . 72.24 111.074 179.931 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 3.6 p -111.0 167.07 10.53 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.197 -0.456 . . . . 73.25 111.174 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 57.68 19.59 35.99 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.739 -0.743 . . . . 64.24 112.538 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.1 mtt -119.55 161.09 21.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.795 0.331 . . . . 75.23 110.883 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.405 ' HA ' ' HB ' ' A' ' 58' ' ' VAL . 26.2 tp -164.35 85.38 0.44 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.27 -0.423 . . . . 74.32 110.99 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 175.52 -29.17 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.188 -0.46 . . . . 61.31 110.86 179.907 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 23.5 m -89.77 -101.29 0.1 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.235 -0.439 . . . . 75.25 110.811 -179.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.79 -28.54 26.09 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.125 -0.489 . . . . 74.13 110.927 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.405 ' HB ' ' HA ' ' A' ' 54' ' ' LEU . 43.6 t -64.63 -42.69 95.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.125 -0.489 . . . . 72.2 111.12 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 1.5 mm -74.61 -31.43 27.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.161 -0.472 . . . . 75.2 111.127 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -58.97 -40.16 83.93 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.15 -0.477 . . . . 73.45 110.913 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.44 HG13 ' N ' ' A' ' 62' ' ' MET . 1.2 pp -68.17 -28.98 42.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.088 -0.505 . . . . 74.52 111.124 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' MET . . . . . 0.44 ' N ' HG13 ' A' ' 61' ' ' ILE . 3.3 mmt -60.54 -40.19 90.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.182 -0.463 . . . . 74.01 110.891 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -84.46 -23.76 29.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.219 -0.446 . . . . 45.15 110.892 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.37 112.1 41.59 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.533 0.682 . . . . 75.32 110.873 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 151.8 69.12 Favored 'Trans proline' 0 N--CA 1.465 -0.188 0 C-N-CA 122.707 2.271 . . . . 72.11 112.367 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -145.75 -68.84 0.28 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.217 -0.447 . . . . 73.22 110.843 -179.939 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -145.21 151.89 39.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.243 -0.435 . . . . 72.31 110.889 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.597 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -88.02 4.27 85.59 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.742 -0.742 . . . . 64.23 112.495 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -92.89 135.24 26.28 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.645 0.735 . . . . 74.23 111.111 -179.912 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 151.93 69.1 Favored 'Trans proline' 0 C--O 1.231 0.143 0 C-N-CA 122.679 2.253 . . . . 63.44 112.321 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -58.91 -30.86 68.13 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.166 -0.47 . . . . 74.45 110.864 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 8.9 m -110.91 129.13 66.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.208 -0.451 . . . . 73.52 111.111 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -130.84 170.42 14.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.203 -0.453 . . . . 73.13 111.17 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -172.59 154.93 3.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.283 -0.417 . . . . 74.13 110.889 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -170.25 165.34 9.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.157 -0.474 . . . . 71.51 110.884 -179.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -51.84 160.29 0.71 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.111 -0.495 . . . . 74.2 110.804 -179.811 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.3 tp -95.41 32.82 1.69 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.064 -0.516 . . . . 70.34 110.903 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . 0.474 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 0.7 OUTLIER -68.88 -60.62 4.25 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.588 0.709 . . . . 71.24 110.861 179.95 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.474 ' HD2' ' N ' ' A' ' 78' ' ' PHE . 53.4 Cg_endo -69.72 117.36 5.03 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.681 2.254 . . . . 73.34 112.33 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -51.52 123.13 9.19 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.24 -0.437 . . . . 74.43 110.932 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 63.48 155.64 0.12 Allowed Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.628 0.728 . . . . 70.4 110.902 -179.815 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 -49.28 0.58 Allowed 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.688 2.259 . . . . 72.25 112.319 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 20.4 mttp -78.31 161.16 27.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.263 -0.426 . . . . 72.53 110.849 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . 0.425 ' CD1' ' HA ' ' A' ' 200' ' ' LEU . 27.2 m95 -49.88 116.42 1.8 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.217 -0.447 . . . . 73.31 110.906 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 6.4 m -115.17 1.05 13.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.262 -0.427 . . . . 71.34 111.132 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.8 m -66.33 -176.61 0.45 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.197 -0.456 . . . . 73.12 110.842 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 4.0 mttt -92.07 -23.08 19.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.102 -0.499 . . . . 71.12 110.94 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -154.29 143.49 13.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.226 -0.443 . . . . 74.14 111.064 179.866 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 99.6 t -117.81 130.36 72.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.142 -0.481 . . . . 72.25 111.119 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 28.8 p -122.09 162.34 21.42 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.16 -0.473 . . . . 75.51 111.157 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 4.0 p90 -151.24 146.59 26.17 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.223 -0.444 . . . . 70.51 110.932 -179.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 10.4 ttt180 -148.36 135.88 20.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.124 -0.489 . . . . 74.3 110.899 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.413 HD11 ' HA ' ' A' ' 106' ' ' ASP . 3.9 mp -74.82 135.46 27.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.205 -0.452 . . . . 72.4 111.173 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.414 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 19.9 t -90.33 -40.48 12.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.19 -0.459 . . . . 74.41 111.105 179.909 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 40.9 t -144.16 164.45 30.65 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.174 -0.466 . . . . 64.24 110.863 -179.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 6.1 p90 -111.47 153.41 26.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.159 -0.473 . . . . 74.1 110.958 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' THR . . . . . 0.447 ' O ' ' O ' ' A' ' 100' ' ' LEU . 0.2 OUTLIER -82.61 140.97 32.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.128 -0.487 . . . . 75.33 111.136 -179.949 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 10.8 ptp180 -73.21 -7.88 53.38 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.214 -0.448 . . . . 72.14 110.893 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -96.42 -26.05 15.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.232 -0.44 . . . . 74.13 110.927 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.447 ' O ' ' O ' ' A' ' 97' ' ' THR . 0.5 OUTLIER -133.55 153.75 80.44 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.57 0.7 . . . . 72.52 110.928 -179.936 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . 0.425 ' HB2' HG23 ' A' ' 103' ' ' ILE . 54.5 Cg_endo -69.7 150.9 69.16 Favored 'Trans proline' 0 N--CA 1.465 -0.187 0 C-N-CA 122.744 2.296 . . . . 73.11 112.359 179.825 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 16.3 t-160 -53.22 -25.79 15.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.304 -0.407 . . . . 74.11 110.817 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.425 HG23 ' HB2' ' A' ' 101' ' ' PRO . 15.2 tt -76.62 -39.15 31.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.449 . . . . 74.02 111.119 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 3.3 m -69.2 -38.91 78.86 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.166 -0.47 . . . . 54.24 111.157 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 97.3 t -72.72 -44.85 58.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.172 -0.467 . . . . 73.13 111.111 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.603 ' O ' HG21 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -66.27 -41.79 89.39 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.257 -0.429 . . . . 63.44 110.851 179.893 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -70.04 -34.23 72.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 75.02 110.909 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.574 ' HB3' ' HD2' ' A' ' 188' ' ' PHE . 0.0 OUTLIER -61.05 -48.1 83.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.162 -0.472 . . . . 75.05 110.935 -179.991 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.603 HG21 ' O ' ' A' ' 106' ' ' ASP . 1.4 m -55.37 -41.37 61.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.218 -0.446 . . . . 72.31 111.095 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.463 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 32.1 t -70.08 -33.8 72.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.17 -0.468 . . . . 72.14 110.894 -179.807 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.28 -33.26 74.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.09 -0.504 . . . . 74.35 110.873 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -95.68 -40.53 9.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.219 -0.446 . . . . 74.32 111.114 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.424 ' HB2' ' HG ' ' A' ' 196' ' ' LEU . 0.4 OUTLIER -65.32 -32.8 74.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.263 -0.426 . . . . 74.11 110.954 -179.984 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 15.4 t30 -65.49 -39.85 92.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.172 -0.467 . . . . 75.15 110.887 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.85 -34.95 73.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.107 -0.497 . . . . 74.0 110.868 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 28.2 m95 -66.59 -52.28 47.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.282 -0.417 . . . . 75.23 110.947 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -60.13 -36.17 89.79 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.754 -0.736 . . . . 73.44 112.45 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.3 mmpt? -64.67 -14.09 56.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.724 0.297 . . . . 74.42 110.95 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -99.11 -13.81 19.64 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.226 -0.443 . . . . 75.55 110.873 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.422 ' C ' ' H ' ' A' ' 122' ' ' LEU . 6.9 pt -122.79 142.92 38.95 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.619 0.723 . . . . 71.34 111.121 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.8 8.54 0.75 Allowed 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.708 2.272 . . . . 75.35 112.364 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.422 ' H ' ' C ' ' A' ' 120' ' ' ILE . 16.4 mt -61.26 -163.17 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.216 -0.447 . . . . 73.22 110.938 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.407 ' H ' ' HB3' ' A' ' 122' ' ' LEU . 3.3 t60 -144.87 122.98 12.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.196 -0.457 . . . . 74.12 110.861 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 9.2 m-30 -107.49 141.47 38.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 75.54 110.86 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.93 141.63 51.88 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.164 -0.471 . . . . 75.14 110.911 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.85 152.5 28.15 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.263 -0.426 . . . . 74.04 110.876 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . 0.408 HG13 ' CB ' ' A' ' 132' ' ' ALA . 29.3 m -103.17 126.24 57.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.176 -0.466 . . . . 50.13 111.137 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -144.9 -11.08 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.151 -0.477 . . . . 74.43 111.126 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -157.0 109.24 2.46 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.166 -0.47 . . . . 73.32 110.869 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 108.22 -162.49 13.06 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.726 -0.749 . . . . 62.11 112.505 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.88 156.35 17.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.79 0.328 . . . . 71.11 111.132 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . 0.408 ' CB ' HG13 ' A' ' 127' ' ' VAL . . . -111.62 165.28 12.15 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.196 -0.456 . . . . 72.32 111.109 179.852 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -73.41 -55.1 6.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 75.41 110.819 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 4.8 mp -92.68 107.48 19.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.205 -0.452 . . . . 71.04 111.143 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' MET . . . . . 0.414 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 14.0 mmm -91.54 128.18 37.27 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.207 -0.451 . . . . 72.43 110.887 179.849 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -106.13 94.74 3.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.263 -0.426 . . . . 70.04 111.098 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -134.59 160.56 24.27 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.732 -0.747 . . . . 63.34 112.47 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 49.2 m-85 -105.08 149.53 25.76 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.82 0.343 . . . . 74.01 110.912 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . 169.43 166.83 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.203 -0.453 . . . . 71.21 111.074 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -104.44 173.27 6.38 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.189 -0.459 . . . . 72.34 110.928 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -55.36 -17.1 11.2 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.72 -0.753 . . . . 74.24 112.524 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -88.3 12.93 12.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.829 0.347 . . . . 75.03 111.109 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 5.9 p80 -80.67 -22.11 40.73 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.184 -0.462 . . . . 73.45 110.939 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 139.34 38.7 0.1 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.808 -0.71 . . . . 60.43 112.495 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 54.1 p-10 -150.18 152.01 33.98 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.823 0.344 . . . . 72.14 110.869 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 96.0 p -73.4 -179.74 3.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.175 -0.466 . . . . 64.54 110.861 -179.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 68.6 121.08 0.03 OUTLIER Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.659 0.742 . . . . 73.4 110.897 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.75 144.88 55.52 Favored 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 122.665 2.243 . . . . 74.53 112.391 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 149' ' ' PHE . . . . . 0.429 ' CE1' ' HB2' ' A' ' 173' ' ' ASP . 0.1 OUTLIER -90.89 -32.78 15.89 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.182 -0.463 . . . . 70.0 110.926 -179.975 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 73.88 -1.26 3.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.158 -0.474 . . . . 72.24 110.859 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . 0.641 ' O ' 'CA ' ' A' ' 302' ' ' ' CA' . . . 49.58 -108.37 0.44 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.809 -0.71 . . . . 75.42 112.504 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.84 139.61 40.37 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.58 2.186 . . . . 75.11 112.419 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 103.23 -155.16 18.08 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.745 -0.741 . . . . 70.32 112.497 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 154' ' ' ASN . . . . . 0.436 ' O ' ' CB ' ' A' ' 155' ' ' THR . 2.9 p30 -42.06 153.75 0.06 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.989 0.423 . . . . 74.45 110.857 -179.834 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 155' ' ' THR . . . . . 0.436 ' CB ' ' O ' ' A' ' 154' ' ' ASN . 1.2 m 80.15 114.53 0.06 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.149 -0.478 . . . . 63.14 111.155 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . 0.47 HD11 HG13 ' A' ' 186' ' ' ILE . 0.7 OUTLIER -99.72 -51.64 3.68 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.255 -0.43 . . . . 75.02 110.984 179.928 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . 0.597 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -163.4 148.11 11.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.176 -0.465 . . . . 73.44 111.12 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 21.3 p-80 -108.13 124.92 50.98 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.257 -0.428 . . . . 74.34 110.873 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -110.73 156.26 21.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.239 -0.437 . . . . 74.42 111.065 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 13.0 m-30 -117.05 150.89 37.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.208 -0.451 . . . . 75.31 110.864 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -79.87 164.55 52.52 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 121.591 0.71 . . . . 71.14 111.078 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 78.38 1.01 Allowed 'Trans proline' 0 C--N 1.341 0.156 0 C-N-CA 122.707 2.271 . . . . 74.44 112.316 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -140.29 128.55 3.88 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.722 -0.752 . . . . 72.32 112.507 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 64.64 -169.96 0.2 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.848 0.356 . . . . 73.1 111.113 -179.87 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -85.63 -49.86 4.2 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.727 -0.749 . . . . 74.03 112.483 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 8.2 tt -68.14 -27.52 66.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.869 0.366 . . . . 75.02 110.947 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -84.04 159.92 36.34 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.801 -0.714 . . . . 43.43 112.467 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 88.26 23.07 38.69 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.766 -0.731 . . . . 74.31 112.498 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 -101.14 164.4 11.81 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.862 0.363 . . . . 63.41 110.83 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.13 130.44 55.9 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.16 -0.473 . . . . 74.21 111.118 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 21.2 m170 -125.9 158.54 34.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.242 -0.435 . . . . 72.53 110.81 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -139.45 139.09 36.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.176 -0.466 . . . . 71.44 110.898 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 173' ' ' ASP . . . . . 0.429 ' HB2' ' CE1' ' A' ' 149' ' ' PHE . 67.1 t0 -67.65 97.61 0.63 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.165 -0.47 . . . . 74.11 110.863 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.05 -16.05 11.44 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.137 -0.483 . . . . 74.45 110.905 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -79.16 -16.42 56.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.135 -0.484 . . . . 73.32 110.832 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 37.2 mm-40 -83.17 -173.66 4.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.158 -0.474 . . . . 71.41 110.927 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 78.7 mtt180 -110.33 110.92 21.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.222 -0.445 . . . . 74.32 110.935 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 68.1 m95 -110.86 134.39 52.58 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.196 -0.456 . . . . 74.32 110.957 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 7.4 t -177.28 163.62 2.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.225 -0.443 . . . . 74.13 111.077 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -125.22 -70.25 0.75 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.165 -0.471 . . . . 61.52 110.847 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -63.06 -13.42 48.43 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.804 -0.712 . . . . 62.41 112.529 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 182' ' ' SER . . . . . 0.418 ' O ' ' C ' ' A' ' 183' ' ' SER . 0.3 OUTLIER -93.1 -24.44 18.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.885 0.374 . . . . 74.0 110.89 -179.739 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 183' ' ' SER . . . . . 0.418 ' C ' ' O ' ' A' ' 182' ' ' SER . 89.5 p 36.04 58.53 0.95 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 64.12 110.866 -179.814 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -116.85 -33.48 4.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.154 -0.475 . . . . 74.43 110.894 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -119.52 -138.58 5.76 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.713 -0.756 . . . . 74.22 112.491 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 186' ' ' ILE . . . . . 0.47 HG13 HD11 ' A' ' 156' ' ' LEU . 9.2 mm -79.49 102.98 5.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 120.798 0.332 . . . . 73.22 111.115 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -48.96 119.54 3.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.202 -0.454 . . . . 71.31 110.866 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 188' ' ' PHE . . . . . 0.574 ' HD2' ' HB3' ' A' ' 108' ' ' LEU . 1.3 t80 -53.94 -33.72 57.59 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.172 -0.467 . . . . 75.45 110.914 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.1 -47.49 71.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.101 -0.499 . . . . 60.14 110.995 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.42 -42.54 74.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.16 -0.473 . . . . 74.22 110.927 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -68.92 -35.28 76.63 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.125 -0.489 . . . . 61.32 111.124 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 192' ' ' ALA . . . . . 0.448 ' O ' ' HB2' ' A' ' 196' ' ' LEU . . . -56.84 -43.08 80.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.256 -0.429 . . . . 52.32 111.071 179.886 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.65 -41.45 81.47 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.208 -0.451 . . . . 72.43 111.113 -179.851 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 5.3 t-160 -73.34 -45.62 54.06 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.207 -0.451 . . . . 71.44 110.888 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -67.49 -48.91 65.74 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.157 -0.474 . . . . 71.01 111.057 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 196' ' ' LEU . . . . . 0.499 ' N ' HD21 ' A' ' 196' ' ' LEU . 4.2 mm? -66.31 -37.36 85.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.293 -0.412 . . . . 74.52 110.924 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -65.4 -28.49 73.64 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.744 -0.741 . . . . 62.43 112.461 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 198' ' ' HIS . . . . . . . . . . . . . 4.0 m-70 -66.87 -37.9 85.29 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.84 0.352 . . . . 75.21 110.873 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -64.46 -20.92 66.48 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.218 -0.446 . . . . 73.13 110.808 -179.764 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 200' ' ' LEU . . . . . 0.425 ' HA ' ' CD1' ' A' ' 84' ' ' TRP . 0.6 OUTLIER -88.5 0.63 56.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.216 -0.447 . . . . 75.12 110.854 -179.969 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 84.1 -6.34 75.88 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.807 -0.711 . . . . 50.41 112.452 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 202' ' ' MET . . . . . . . . . . . . . 36.5 tpp -50.27 139.27 15.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.877 0.37 . . . . 71.04 110.798 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -103.26 158.98 17.3 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.751 -0.738 . . . . 64.44 112.438 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 27.3 m-70 -58.22 150.96 20.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.784 0.326 . . . . 74.32 110.881 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -116.39 146.87 42.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.261 -0.427 . . . . 72.42 110.814 -179.754 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 88.7 p -87.96 -4.74 58.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.106 -0.497 . . . . 72.22 110.889 -179.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.64 136.47 83.26 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.61 0.719 . . . . 65.11 110.849 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.75 -8.21 23.02 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.681 2.254 . . . . 74.53 112.417 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -122.92 23.02 9.5 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.16 -0.473 . . . . 63.52 110.948 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 210' ' ' ALA . . . . . 0.428 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.25 145.81 26.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.08 -0.509 . . . . 64.4 111.102 179.841 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -69.55 -29.01 39.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.229 -0.441 . . . . 75.23 111.132 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -93.53 10.36 32.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.151 -0.477 . . . . 75.22 110.882 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 213' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -55.56 114.68 7.74 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-O 121.699 0.761 . . . . 73.43 110.958 -179.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 -20.0 35.41 Favored 'Trans proline' 0 C--O 1.232 0.211 0 C-N-CA 122.639 2.226 . . . . 63.01 112.315 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -86.45 49.18 1.75 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.255 -0.43 . . . . 74.24 111.128 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 6.5 t80 -61.69 124.13 19.87 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.251 -0.431 . . . . 74.42 110.937 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -157.27 -122.14 0.7 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.744 -0.741 . . . . 74.22 112.454 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -56.44 177.36 0.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.859 0.361 . . . . 64.22 110.905 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . 71.3 98.81 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.741 -0.742 . . . . 73.55 112.516 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 220' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -119.75 101.37 48.22 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-O 121.545 0.688 . . . . 73.41 110.878 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.82 142.79 48.58 Favored 'Trans proline' 0 C--N 1.341 0.145 0 C-N-CA 122.646 2.231 . . . . 74.21 112.362 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -81.46 -22.83 37.83 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.191 -0.459 . . . . 75.43 110.848 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -125.57 -35.63 2.53 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.284 -0.416 . . . . 70.33 110.861 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER 66.26 143.97 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.178 -0.465 . . . . 71.11 110.866 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -143.19 163.01 34.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.165 -0.47 . . . . 65.02 110.941 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 14.9 mt -61.77 148.99 41.23 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.276 -0.42 . . . . 62.53 110.968 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 227' ' ' SER . . . . . 0.428 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 0.3 OUTLIER -86.95 148.33 25.38 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.237 -0.438 . . . . 74.21 110.787 -179.836 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -60.5 -68.71 0.27 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.14 -0.482 . . . . 74.54 110.935 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.48 -25.42 36.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.217 -0.447 . . . . 74.2 110.828 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -68.89 -48.31 63.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.196 -0.456 . . . . 74.23 110.86 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 231' ' ' ILE . . . . . . . . . . . . . 8.0 mt -68.55 -42.67 83.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.236 -0.438 . . . . 73.41 111.096 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 14.0 ptmt -64.73 -32.38 74.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.242 -0.435 . . . . 73.32 110.889 179.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -62.9 -50.07 66.96 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.767 -0.73 . . . . 65.45 112.475 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -73.15 -30.5 31.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.862 0.363 . . . . 74.41 111.195 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 15.3 mt-30 -67.13 -24.28 65.9 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.136 -0.483 . . . . 71.13 110.984 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 236' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.09 -26.59 60.45 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.143 -0.481 . . . . 74.41 110.874 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 237' ' ' LEU . . . . . . . . . . . . . 8.1 tt -97.63 -28.94 13.7 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.22 -0.445 . . . . 75.41 110.949 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 238' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -92.11 -35.15 14.05 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.19 -0.459 . . . . 54.42 110.958 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -136.59 -119.74 1.89 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.756 -0.735 . . . . 72.22 112.504 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.56 152.82 20.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.777 0.322 . . . . 75.42 110.866 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 1.3 ptm180 -96.78 -169.71 1.93 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.2 -0.454 . . . . 73.34 110.853 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -173.97 44.54 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.168 -0.469 . . . . 62.43 110.848 -179.796 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 17.1 t-20 63.32 82.14 0.19 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.118 -0.492 . . . . 72.13 110.934 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 22.3 p -173.4 140.46 0.83 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.243 -0.435 . . . . 71.41 110.897 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -178.59 175.98 1.05 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.161 -0.472 . . . . 75.43 110.863 -179.888 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.94 -174.9 0.82 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.187 -0.46 . . . . 72.11 110.884 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.229 -0.441 . . . . 74.13 110.877 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 302' ' ' ' CA' . . . . . 0.641 'CA ' ' O ' ' A' ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' -2' ' ' LEU . . . . . . . . . . . . . 4.4 mm? . . . . . 0 C--O 1.231 0.115 0 CA-C-O 121.539 0.685 . . . . 73.02 110.915 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' -1' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.7 112.42 3.06 Favored 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.677 2.252 . . . . 73.21 112.345 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 0' ' ' LEU . . . . . 0.478 ' N ' ' HD2' ' A' ' 1' ' ' PRO . 2.3 mm? -68.67 -60.48 4.57 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.589 0.709 . . . . 75.23 110.877 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . 0.478 ' HD2' ' N ' ' A' ' 0' ' ' LEU . 54.5 Cg_endo -69.71 170.29 16.86 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.696 2.264 . . . . 64.24 112.388 179.826 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -116.34 131.56 56.91 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.236 -0.438 . . . . 62.24 110.89 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -95.48 -15.24 23.06 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.234 -0.439 . . . . 74.01 110.9 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.29 -33.89 65.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.169 -0.469 . . . . 71.4 111.18 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -55.83 -42.75 86.55 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.734 -0.746 . . . . 62.21 112.517 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -109.07 21.51 26.98 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.778 -0.725 . . . . 54.42 112.47 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -78.38 153.71 31.36 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.783 0.325 . . . . 72.23 110.925 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.1 m -97.3 168.71 10.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.249 -0.432 . . . . 73.24 110.812 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -54.23 -31.93 54.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.118 -0.492 . . . . 73.44 110.927 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 7.0 tp -62.04 -40.62 96.37 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.166 -0.47 . . . . 72.33 110.963 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -61.73 -45.06 95.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.124 -0.489 . . . . 72.14 110.917 179.935 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 40.5 t-105 -73.17 -33.8 65.66 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.227 -0.442 . . . . 71.22 110.92 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -67.61 -35.47 79.02 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.274 -0.421 . . . . 72.51 110.93 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 16.9 mm-40 -65.73 -36.72 84.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.108 -0.496 . . . . 74.32 110.905 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.28 -38.91 74.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.234 -0.439 . . . . 74.22 111.059 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -72.7 -42.98 63.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.212 -0.449 . . . . 73.12 110.867 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.512 ' O ' ' HG3' ' A' ' 20' ' ' LYS . 2.9 m-20 -67.06 -31.49 72.04 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.258 -0.428 . . . . 72.4 110.86 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.471 ' HA ' ' HG2' ' A' ' 21' ' ' ARG . 3.2 m-85 -72.07 -43.07 65.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.153 -0.476 . . . . 75.11 110.914 -179.809 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -73.61 -33.78 64.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.471 . . . . 75.43 110.879 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.512 ' HG3' ' O ' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -73.06 -35.84 66.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.183 -0.462 . . . . 75.45 110.927 179.769 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.471 ' HG2' ' HA ' ' A' ' 18' ' ' TYR . 0.6 OUTLIER -71.5 -27.96 63.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.208 -0.451 . . . . 74.22 110.869 -179.956 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -60.08 -25.28 65.28 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.193 -0.458 . . . . 75.2 110.833 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -120.78 50.49 1.34 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.203 -0.453 . . . . 74.4 110.899 -179.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.0 mt 69.47 -162.14 0.17 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.144 -0.48 . . . . 75.43 110.911 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -80.88 89.56 5.86 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.181 -0.463 . . . . 71.41 110.984 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 54.8 m-20 -97.41 90.28 5.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.086 -0.506 . . . . 74.25 110.84 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 13.7 m -85.2 -25.16 27.54 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.129 -0.487 . . . . 62.15 110.874 -179.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.9 -15.41 61.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.206 -0.452 . . . . 74.51 110.886 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.4 m -78.38 -2.96 40.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.164 -0.471 . . . . 72.53 111.157 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.37 169.44 0.05 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.196 -0.456 . . . . 74.12 110.886 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 65.84 147.52 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.243 -0.435 . . . . 74.52 110.855 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.96 -26.55 59.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.14 -0.482 . . . . 71.02 111.062 179.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -51.91 -44.98 64.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.274 -0.421 . . . . 71.33 110.887 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -85.52 -22.86 27.96 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.259 -0.428 . . . . 74.02 110.897 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.1 tp -58.83 -39.77 82.24 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.121 -0.491 . . . . 74.54 110.96 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.3 -51.38 63.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.197 -0.456 . . . . 73.13 110.899 179.865 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.34 -38.91 92.99 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.2 -0.454 . . . . 71.12 111.186 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.451 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 2.3 mmtt -69.34 -42.11 75.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.226 -0.443 . . . . 74.43 110.836 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.403 ' O ' ' HG2' ' A' ' 43' ' ' GLN . 1.7 mp -54.48 -38.71 66.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.317 -0.401 . . . . 74.44 110.922 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -58.69 -45.42 89.51 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.171 -0.468 . . . . 74.2 110.905 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.451 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 1.5 pt-20 -60.67 -32.85 72.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.27 -0.423 . . . . 75.11 110.89 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 9.0 ttt -68.52 -34.1 75.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.113 -0.494 . . . . 63.43 110.884 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.427 ' HG3' ' HA ' ' A' ' 51' ' ' THR . 2.5 mm100 -59.95 -39.42 85.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.209 -0.45 . . . . 75.32 110.935 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.9 mmpt? -71.57 -30.6 66.04 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.163 -0.472 . . . . 75.11 110.895 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -70.46 -43.5 69.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.225 -0.443 . . . . 73.32 110.875 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -82.01 -34.95 29.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.127 -0.488 . . . . 70.43 110.852 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 103.07 -6.97 51.78 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.733 -0.746 . . . . 64.42 112.455 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.85 137.28 90.4 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-O 121.657 0.741 . . . . 74.31 110.911 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.69 -52.23 0.34 Allowed 'Trans proline' 0 C--N 1.343 0.239 0 C-N-CA 122.675 2.25 . . . . 74.5 112.32 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -50.96 108.29 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.206 -0.452 . . . . 72.24 111.186 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.427 ' HA ' ' HG3' ' A' ' 43' ' ' GLN . 3.6 p -99.21 152.48 19.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.18 -0.464 . . . . 73.25 111.197 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 59.2 17.73 39.23 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.761 -0.733 . . . . 64.24 112.472 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 15.2 mmt -102.8 161.04 14.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.828 0.347 . . . . 75.23 110.848 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 29.5 tp -168.54 81.94 0.16 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.186 -0.461 . . . . 74.32 110.854 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 174.5 -28.09 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.227 -0.442 . . . . 61.31 110.936 179.877 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.8 p -87.85 -99.86 0.08 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.121 -0.49 . . . . 75.25 110.843 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 17.4 tpt180 -84.97 -29.16 25.3 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.108 -0.496 . . . . 74.13 110.904 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.485 ' O ' HG13 ' A' ' 61' ' ' ILE . 84.7 t -60.95 -45.04 99.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.225 -0.443 . . . . 72.2 111.126 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 7.6 mm -75.37 -31.66 24.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.202 -0.454 . . . . 75.2 111.111 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.6 -44.1 93.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.196 -0.457 . . . . 73.45 110.886 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.485 HG13 ' O ' ' A' ' 58' ' ' VAL . 1.5 pp -66.82 -29.47 46.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.165 -0.47 . . . . 74.52 111.184 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 8.2 mmt -63.0 -38.67 92.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.161 -0.472 . . . . 74.01 110.844 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -84.49 -25.71 28.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.254 -0.43 . . . . 45.15 110.934 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.42 136.24 37.79 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.547 0.689 . . . . 75.32 110.924 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -69.82 156.84 62.16 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.731 2.287 . . . . 72.11 112.28 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.409 ' HG3' ' HA ' ' A' ' 214' ' ' PRO . 13.1 ttp180 -149.88 -83.89 0.1 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.181 -0.463 . . . . 73.22 110.89 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -145.58 153.9 41.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.181 -0.463 . . . . 72.31 110.893 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.554 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -108.02 24.58 22.83 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.745 -0.74 . . . . 64.23 112.457 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -106.69 134.38 19.85 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 121.629 0.728 . . . . 74.23 111.065 -179.947 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 143.32 50.53 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.717 2.278 . . . . 63.44 112.289 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -102.08 24.52 9.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.233 -0.44 . . . . 74.45 110.878 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 3.9 m -142.13 129.92 20.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.221 -0.445 . . . . 73.52 111.13 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -130.9 170.18 14.78 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.153 -0.476 . . . . 73.13 111.126 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 177.2 166.54 0.58 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.225 -0.443 . . . . 74.13 110.863 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER 59.94 170.21 0.08 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.11 -0.496 . . . . 71.51 110.931 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 10.6 m 64.39 155.41 0.07 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.122 -0.49 . . . . 74.2 110.904 -179.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -104.3 96.87 6.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.16 -0.473 . . . . 70.34 110.912 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 4.7 p90 -50.57 157.01 1.36 Allowed Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.649 0.738 . . . . 71.24 110.889 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.416 ' HG3' ' HA2' ' A' ' 163' ' ' GLY . 53.5 Cg_endo -69.88 -175.5 1.21 Allowed 'Trans proline' 0 C--N 1.341 0.147 0 C-N-CA 122.68 2.254 . . . . 73.34 112.328 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -51.21 103.35 0.06 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.243 -0.435 . . . . 74.43 110.892 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 62.65 160.25 0.12 Allowed Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.717 0.77 . . . . 70.4 110.877 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.71 -50.59 0.46 Allowed 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.694 2.262 . . . . 72.25 112.367 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 4.4 mttp -78.82 165.85 23.09 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.217 -0.447 . . . . 72.53 110.91 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . 0.404 ' CD1' ' HA ' ' A' ' 200' ' ' LEU . 52.6 m95 -49.71 137.72 15.49 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.235 -0.439 . . . . 73.31 110.864 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 2.2 t -115.28 -27.14 7.35 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.207 -0.451 . . . . 71.34 111.112 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -53.19 171.41 0.07 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.215 -0.448 . . . . 73.12 110.808 -179.776 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.58 -30.69 20.33 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.133 -0.485 . . . . 71.12 110.905 179.916 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -148.39 140.43 18.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.214 -0.448 . . . . 74.14 111.108 179.888 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 90.4 t -123.35 141.39 43.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.155 -0.475 . . . . 72.25 111.106 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 15.2 p -115.61 155.16 28.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.188 -0.46 . . . . 75.51 111.202 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.435 ' O ' ' CG2' ' A' ' 127' ' ' VAL . 3.9 p90 -137.42 146.61 44.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.265 -0.425 . . . . 70.51 110.911 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 7.7 ttt-85 -150.87 139.09 20.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.123 -0.49 . . . . 74.3 110.9 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.3 mm -75.2 133.97 30.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.197 -0.456 . . . . 72.4 111.099 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.461 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 8.1 t -91.32 -40.63 12.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.162 -0.472 . . . . 74.41 111.114 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -149.05 169.39 20.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.168 -0.469 . . . . 64.24 110.841 -179.818 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 14.8 p90 -132.29 155.01 49.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.161 -0.472 . . . . 74.1 110.925 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.5 t -102.38 141.78 34.66 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.169 -0.469 . . . . 75.33 111.101 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -52.5 -18.7 1.81 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.449 . . . . 72.14 110.863 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -65.08 -37.07 86.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.21 -0.45 . . . . 74.13 110.9 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.5 mp -142.47 152.11 59.46 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.65 0.738 . . . . 72.52 110.899 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . 0.415 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.9 Cg_endo -69.7 150.94 69.26 Favored 'Trans proline' 0 C--N 1.343 0.244 0 C-N-CA 122.637 2.225 . . . . 73.11 112.362 179.879 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -52.19 -27.84 16.1 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.19 -0.459 . . . . 74.11 110.828 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.415 HG22 ' HB2' ' A' ' 101' ' ' PRO . 2.2 tp -75.22 -38.91 42.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.212 -0.449 . . . . 74.02 111.173 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 2.9 m -69.34 -36.84 77.32 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.144 -0.48 . . . . 54.24 111.183 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 55.2 t -71.43 -43.44 72.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.159 -0.473 . . . . 73.13 111.105 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.598 ' O ' HG22 ' A' ' 109' ' ' VAL . 24.9 t0 -66.54 -37.57 85.29 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.123 -0.489 . . . . 63.44 110.881 179.878 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . 0.501 ' HG3' ' N ' ' A' ' 108' ' ' LEU . 0.0 OUTLIER -70.36 -33.38 71.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.248 -0.433 . . . . 75.02 110.829 -179.865 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.517 ' HB3' ' HD1' ' A' ' 188' ' ' PHE . 0.0 OUTLIER -66.11 -48.97 69.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.229 -0.441 . . . . 75.05 110.849 -179.891 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.598 HG22 ' O ' ' A' ' 106' ' ' ASP . 1.4 m -55.13 -43.27 69.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.228 -0.442 . . . . 72.31 111.108 179.82 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.494 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 48.2 t -70.7 -34.33 71.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.149 -0.478 . . . . 72.14 110.867 -179.814 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.56 -33.34 74.74 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.136 -0.483 . . . . 74.35 110.948 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -95.39 -40.49 9.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.254 -0.43 . . . . 74.32 111.108 179.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.54 -32.76 74.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.197 -0.456 . . . . 74.11 110.939 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 42.4 t30 -65.48 -35.29 80.46 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.187 -0.46 . . . . 75.15 110.84 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' MET . . . . . 0.415 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 0.0 OUTLIER -68.31 -34.52 76.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.188 -0.46 . . . . 74.0 110.813 179.992 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' TRP . . . . . 0.406 ' O ' HG12 ' A' ' 120' ' ' ILE . 6.0 m95 -66.99 -44.86 79.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.287 -0.415 . . . . 75.23 111.006 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -73.39 -40.74 47.56 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.73 -0.748 . . . . 73.44 112.45 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . 0.415 ' HG2' ' O ' ' A' ' 115' ' ' MET . 3.8 ptpt -60.75 -18.43 54.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.811 0.338 . . . . 74.42 110.92 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.43 ' HG2' HG12 ' A' ' 231' ' ' ILE . 0.1 OUTLIER -96.87 13.46 28.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.167 -0.47 . . . . 75.55 110.884 179.934 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.406 HG12 ' O ' ' A' ' 116' ' ' TRP . 3.6 pt -147.92 156.0 44.15 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.591 0.71 . . . . 71.34 111.15 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.77 0.27 5.9 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.675 2.25 . . . . 75.35 112.334 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.408 ' HB3' ' H ' ' A' ' 123' ' ' HIS . 12.5 mt -61.18 -157.92 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.229 -0.441 . . . . 73.22 110.909 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.408 ' H ' ' HB3' ' A' ' 122' ' ' LEU . 4.5 t60 -162.66 137.92 6.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.159 -0.473 . . . . 74.12 110.907 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 17.5 m-30 -122.27 142.35 50.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.199 -0.455 . . . . 75.54 110.889 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.26 140.96 48.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.125 -0.489 . . . . 75.14 110.897 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.19 141.62 34.02 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.196 -0.456 . . . . 74.04 110.886 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . 0.435 ' CG2' ' O ' ' A' ' 91' ' ' TYR . 34.4 m -103.0 139.49 23.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.259 -0.428 . . . . 50.13 111.183 179.8 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -155.13 -29.25 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.165 -0.47 . . . . 74.43 111.077 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -133.22 109.19 9.25 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.146 -0.479 . . . . 73.32 110.881 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.46 -160.69 13.94 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.764 -0.732 . . . . 62.11 112.559 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -101.99 155.77 17.96 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.783 0.325 . . . . 71.11 111.16 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -112.14 165.41 12.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.193 -0.458 . . . . 72.32 111.068 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -69.5 -54.67 13.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.204 -0.453 . . . . 75.41 110.931 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 27.8 mt -83.8 132.57 31.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.138 -0.483 . . . . 71.04 111.111 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' MET . . . . . 0.461 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 28.3 mmt -108.81 116.93 32.93 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.158 -0.474 . . . . 72.43 110.932 179.829 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -106.13 88.39 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.251 -0.432 . . . . 70.04 111.124 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . 0.426 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -130.17 169.48 21.11 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.701 -0.762 . . . . 63.34 112.47 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 36.5 m-85 -112.78 145.88 39.8 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.875 0.369 . . . . 74.01 110.874 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . 173.72 166.44 0.18 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.156 -0.475 . . . . 71.21 111.135 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -104.8 172.96 6.51 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.259 -0.428 . . . . 72.34 110.847 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -54.02 -21.53 17.7 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.69 -0.766 . . . . 74.24 112.476 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -67.08 -12.07 58.9 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.812 0.339 . . . . 75.03 111.092 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 2.0 p80 -68.92 -11.6 60.79 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.252 -0.431 . . . . 73.45 110.855 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 117.68 36.57 0.97 Allowed Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.723 -0.751 . . . . 60.43 112.5 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -120.91 139.97 52.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.76 0.315 . . . . 72.14 110.937 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.23 161.76 18.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.451 . . . . 64.54 110.842 -179.7 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 11.9 m-85 64.71 133.52 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.649 0.738 . . . . 73.4 110.91 -179.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.79 134.81 28.82 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.621 2.214 . . . . 74.53 112.336 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -73.59 -33.1 64.45 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.207 -0.451 . . . . 70.0 110.851 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 74.57 -2.5 2.8 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.186 -0.461 . . . . 72.24 110.9 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . 0.676 ' O ' 'CA ' ' A' ' 302' ' ' ' CA' . . . 49.5 -108.72 0.49 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.706 -0.759 . . . . 75.42 112.531 -179.855 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.87 139.02 38.83 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.627 2.218 . . . . 75.11 112.325 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 103.21 -153.28 18.09 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.752 -0.737 . . . . 70.32 112.425 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -41.87 155.1 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.898 0.38 . . . . 74.45 110.894 -179.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 75.31 108.78 0.07 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.132 -0.485 . . . . 63.14 111.158 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . 0.457 HD11 HG13 ' A' ' 186' ' ' ILE . 0.5 OUTLIER -90.53 -53.67 4.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.177 -0.465 . . . . 75.02 110.866 -179.98 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . 0.554 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -165.42 148.37 7.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.185 -0.461 . . . . 73.44 111.149 179.823 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 24.0 p-80 -106.13 126.53 52.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.245 -0.434 . . . . 74.34 110.84 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -110.91 160.9 16.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.155 -0.475 . . . . 74.42 111.061 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 13.6 m-85 -111.68 156.96 21.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.215 -0.448 . . . . 75.31 110.913 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -87.79 164.09 35.62 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 121.586 0.708 . . . . 71.14 111.155 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.71 81.8 0.78 Allowed 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.755 2.304 . . . . 74.44 112.37 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 163' ' ' GLY . . . . . 0.416 ' HA2' ' HG3' ' A' ' 79' ' ' PRO . . . -146.7 128.8 3.11 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.727 -0.749 . . . . 72.32 112.448 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 63.9 -172.36 0.17 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.8 0.333 . . . . 73.1 111.174 -179.864 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -87.41 -41.51 6.49 Favored Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.736 -0.745 . . . . 74.03 112.409 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 8.8 tt -71.4 -32.78 68.82 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.84 0.352 . . . . 75.02 110.85 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -79.35 172.45 55.11 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.665 -0.778 . . . . 43.43 112.467 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 78.03 23.08 67.13 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.679 -0.772 . . . . 74.31 112.479 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 95.2 m-20 -97.23 167.49 11.0 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.892 0.377 . . . . 63.41 110.837 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.91 130.34 56.15 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.151 -0.477 . . . . 74.21 111.096 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 16.2 m170 -127.24 132.91 50.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.221 -0.445 . . . . 72.53 110.791 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 172' ' ' PHE . . . . . 0.451 ' HA ' ' HB3' ' A' ' 157' ' ' ALA . 41.9 m-85 -116.86 139.59 50.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.171 -0.468 . . . . 71.44 110.904 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 65.4 t0 -69.38 97.18 0.95 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.151 -0.477 . . . . 74.11 110.861 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.97 -16.66 7.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.166 -0.47 . . . . 74.45 110.85 -179.858 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -79.48 -19.66 49.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.14 -0.482 . . . . 73.32 110.811 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -78.81 -174.87 4.17 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.237 -0.438 . . . . 71.41 110.932 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 177' ' ' ARG . . . . . 0.421 ' HG3' ' HA3' ' A' ' 185' ' ' GLY . 1.4 ptm180 -116.54 116.74 28.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.222 -0.444 . . . . 74.32 110.831 -179.874 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 21.4 m95 -117.11 148.14 41.8 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.142 -0.481 . . . . 74.32 110.856 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 7.5 t 179.16 163.65 0.87 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.206 -0.452 . . . . 74.13 111.167 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -128.35 -68.26 0.77 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.171 -0.468 . . . . 61.52 110.87 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -60.34 -15.16 37.14 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.672 -0.775 . . . . 62.41 112.536 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -97.51 -24.33 15.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.865 0.364 . . . . 74.0 110.862 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 66.7 m 37.84 56.42 1.56 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.158 -0.474 . . . . 64.12 110.821 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 1.3 tp -116.9 -33.2 4.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.102 -0.499 . . . . 74.43 110.867 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 185' ' ' GLY . . . . . 0.421 ' HA3' ' HG3' ' A' ' 177' ' ' ARG . . . -114.37 -142.25 7.93 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.756 -0.735 . . . . 74.22 112.52 179.912 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 186' ' ' ILE . . . . . 0.457 HG13 HD11 ' A' ' 156' ' ' LEU . 11.1 mm -79.07 97.71 2.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.81 0.338 . . . . 73.22 111.125 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -45.53 117.21 1.36 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.199 -0.455 . . . . 71.31 110.815 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 188' ' ' PHE . . . . . 0.517 ' HD1' ' HB3' ' A' ' 108' ' ' LEU . 1.7 t80 -54.09 -36.91 63.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.106 -0.497 . . . . 75.45 110.868 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . 0.401 HD22 HD12 ' A' ' 108' ' ' LEU . 0.0 OUTLIER -67.21 -47.33 71.2 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.135 -0.484 . . . . 60.14 110.886 -179.94 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -68.93 -41.43 78.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.177 -0.465 . . . . 74.22 110.953 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -69.11 -35.19 76.16 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.138 -0.483 . . . . 61.32 111.062 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 192' ' ' ALA . . . . . 0.463 ' O ' ' HB2' ' A' ' 196' ' ' LEU . . . -57.26 -44.05 83.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.225 -0.443 . . . . 52.32 111.034 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.08 -43.49 87.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.226 -0.443 . . . . 72.43 111.169 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 17.6 t-160 -73.12 -42.06 63.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.206 -0.452 . . . . 71.44 110.82 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -70.12 -47.53 61.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.206 -0.452 . . . . 71.01 111.114 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 196' ' ' LEU . . . . . 0.488 ' N ' HD21 ' A' ' 196' ' ' LEU . 4.5 mm? -64.54 -37.94 89.3 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.192 -0.458 . . . . 74.52 110.901 -179.947 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -60.97 -27.29 66.82 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.757 -0.735 . . . . 62.43 112.501 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 198' ' ' HIS . . . . . . . . . . . . . 6.5 m-70 -67.98 -35.69 78.76 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.732 0.301 . . . . 75.21 110.799 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.96 -20.88 65.1 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.282 -0.417 . . . . 73.13 110.837 -179.764 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 200' ' ' LEU . . . . . 0.448 ' HB2' ' HG2' ' A' ' 202' ' ' MET . 0.5 OUTLIER -88.02 -0.04 56.53 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.175 -0.466 . . . . 75.12 110.926 -179.992 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 83.97 5.53 87.65 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.723 -0.751 . . . . 50.41 112.533 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 202' ' ' MET . . . . . 0.448 ' HG2' ' HB2' ' A' ' 200' ' ' LEU . 97.7 mmm -62.73 173.11 1.39 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.781 0.324 . . . . 71.04 110.907 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -137.16 169.19 24.08 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.779 -0.724 . . . . 64.44 112.535 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 20.5 m-70 -66.84 151.49 47.41 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.768 0.318 . . . . 74.32 110.857 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -118.99 146.06 45.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.222 -0.445 . . . . 72.42 110.835 -179.771 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 3.6 m -87.86 -4.19 58.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.104 -0.498 . . . . 72.22 110.899 -179.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 207' ' ' ASP . . . . . 0.419 ' O ' ' CD1' ' A' ' 213' ' ' TYR . 0.1 OUTLIER -71.33 142.87 87.36 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.571 0.701 . . . . 65.11 110.874 179.916 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.68 -29.96 23.43 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.658 2.238 . . . . 74.53 112.405 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 3.1 p-10 -105.57 25.36 10.85 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.214 -0.448 . . . . 63.52 110.845 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 210' ' ' ALA . . . . . 0.453 ' O ' ' HB2' ' A' ' 213' ' ' TYR . . . -87.31 146.3 25.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.22 -0.445 . . . . 64.4 111.096 179.814 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 211' ' ' VAL . . . . . 0.531 HG12 ' HG3' ' A' ' 212' ' ' MET . 0.4 OUTLIER -73.59 -26.61 22.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.187 -0.46 . . . . 75.23 111.145 179.974 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 212' ' ' MET . . . . . 0.531 ' HG3' HG12 ' A' ' 211' ' ' VAL . 0.0 OUTLIER -87.86 9.87 20.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.12 -0.491 . . . . 75.22 110.87 179.932 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 213' ' ' TYR . . . . . 0.453 ' HB2' ' O ' ' A' ' 210' ' ' ALA . 0.4 OUTLIER -54.93 120.16 27.01 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.676 0.751 . . . . 73.43 110.88 -179.851 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 214' ' ' PRO . . . . . 0.409 ' HA ' ' HG3' ' A' ' 66' ' ' ARG . 53.4 Cg_endo -69.75 -17.97 37.33 Favored 'Trans proline' 0 C--N 1.342 0.184 0 C-N-CA 122.604 2.203 . . . . 63.01 112.374 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -84.26 -2.4 56.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.18 -0.464 . . . . 74.24 111.2 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 1.5 t80 64.35 150.6 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.173 -0.467 . . . . 74.42 110.954 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -51.71 103.72 0.12 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.742 -0.742 . . . . 74.22 112.458 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -51.62 -59.42 4.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.876 0.37 . . . . 64.22 110.832 -179.868 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . -67.88 -175.07 8.5 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.742 -0.742 . . . . 73.55 112.491 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 220' ' ' ASP . . . . . . . . . . . . . 44.4 t0 -102.6 101.32 19.64 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.576 0.703 . . . . 73.41 110.833 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -69.72 114.36 3.67 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.683 2.255 . . . . 74.21 112.347 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -81.5 -38.6 26.04 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.237 -0.438 . . . . 75.43 110.937 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -121.81 -32.5 3.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.201 -0.454 . . . . 70.33 110.876 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER 65.65 135.36 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.155 -0.475 . . . . 71.11 110.915 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -143.8 160.55 40.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.455 . . . . 65.02 110.937 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . 0.415 HD11 ' HG2' ' A' ' 119' ' ' GLU . 6.6 mt -63.81 149.53 46.71 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.227 -0.442 . . . . 62.53 110.885 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 227' ' ' SER . . . . . . . . . . . . . 1.3 t -86.68 152.01 22.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.208 -0.451 . . . . 74.21 110.895 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 10.7 tt0 -64.4 -66.02 0.6 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.164 -0.471 . . . . 74.54 110.927 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 229' ' ' ASP . . . . . 0.417 ' O ' ' HG3' ' A' ' 232' ' ' LYS . 0.2 OUTLIER -56.08 -25.58 45.91 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.185 -0.462 . . . . 74.2 110.844 179.979 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -69.69 -48.7 58.74 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.205 -0.452 . . . . 74.23 110.855 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 231' ' ' ILE . . . . . 0.43 HG12 ' HG2' ' A' ' 119' ' ' GLU . 9.2 mt -68.83 -41.58 82.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.152 -0.476 . . . . 73.41 111.12 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 232' ' ' LYS . . . . . 0.425 ' HG3' ' N ' ' A' ' 233' ' ' GLY . 0.0 OUTLIER -56.67 -32.06 65.03 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.167 -0.47 . . . . 73.32 110.89 179.855 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 233' ' ' GLY . . . . . 0.425 ' N ' ' HG3' ' A' ' 232' ' ' LYS . . . -64.95 -49.94 60.45 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.731 -0.747 . . . . 65.45 112.464 179.942 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 7.9 tt -72.84 -30.56 33.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.776 0.322 . . . . 74.41 111.173 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 13.0 mt-30 -69.72 -24.31 63.54 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.13 -0.486 . . . . 71.13 110.908 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 236' ' ' LYS . . . . . 0.462 ' HE2' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -73.81 -26.68 60.74 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.148 -0.478 . . . . 74.41 110.909 179.937 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 237' ' ' LEU . . . . . 0.462 ' HB2' ' HE2' ' A' ' 236' ' ' LYS . 10.3 tt -97.42 -36.17 10.44 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.223 -0.444 . . . . 75.41 110.931 179.911 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 238' ' ' TYR . . . . . . . . . . . . . 54.2 m-85 -92.12 -5.28 53.01 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.181 -0.463 . . . . 54.42 110.877 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -155.58 -117.04 0.56 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.778 -0.725 . . . . 72.22 112.435 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.03 149.59 31.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.709 0.29 . . . . 75.42 110.897 -179.917 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -89.47 -170.27 2.79 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.269 -0.423 . . . . 73.34 110.857 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 47.0 t -157.02 -41.89 0.07 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.227 -0.442 . . . . 62.43 110.902 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 15.0 p-10 -157.25 -174.21 4.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.124 -0.489 . . . . 72.13 110.95 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -92.55 160.72 14.91 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.241 -0.436 . . . . 71.41 110.871 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 7.4 ttp180 -163.87 142.25 7.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.15 -0.477 . . . . 75.43 110.872 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 1.7 tttt -87.62 149.13 24.49 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.189 -0.459 . . . . 72.11 110.85 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 4.8 tmtt? . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.228 -0.442 . . . . 74.13 110.838 179.863 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 302' ' ' ' CA' . . . . . 0.676 'CA ' ' O ' ' A' ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' -2' ' ' LEU . . . . . . . . . . . . . 4.5 mm? . . . . . 0 C--O 1.231 0.129 0 CA-C-O 121.574 0.702 . . . . 73.02 110.878 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' -1' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.85 78.62 1.03 Allowed 'Trans proline' 0 C--O 1.231 0.157 0 C-N-CA 122.671 2.247 . . . . 73.21 112.315 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 0' ' ' LEU . . . . . 0.48 ' N ' ' HD2' ' A' ' 1' ' ' PRO . 2.6 mm? -68.85 -60.5 4.4 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.584 0.707 . . . . 75.23 110.913 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . 0.48 ' HD2' ' N ' ' A' ' 0' ' ' LEU . 54.2 Cg_endo -69.71 -176.56 1.51 Allowed 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.665 2.243 . . . . 64.24 112.355 179.845 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -178.81 39.78 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.217 -0.447 . . . . 62.24 110.923 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -77.13 -7.26 55.47 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.15 -0.477 . . . . 74.01 110.902 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.48 -34.07 66.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.169 -0.469 . . . . 71.4 111.059 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -63.2 -22.59 65.33 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.734 -0.746 . . . . 62.21 112.49 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -108.46 21.6 28.16 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.714 -0.755 . . . . 54.42 112.559 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 26.3 mtm -82.02 164.2 21.59 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.765 0.317 . . . . 72.23 110.821 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.7 m -97.38 168.73 10.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.25 -0.432 . . . . 73.24 110.861 -179.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.25 -33.19 57.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.109 -0.496 . . . . 73.44 110.916 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.35 -42.79 78.7 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.149 -0.478 . . . . 72.33 110.942 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.66 -37.97 76.91 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.178 -0.465 . . . . 72.14 110.909 179.924 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 30.8 t-105 -72.44 -41.2 66.4 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.17 -0.468 . . . . 71.22 110.895 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -68.49 -35.2 77.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.292 -0.413 . . . . 72.51 110.911 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -62.92 -36.52 83.65 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.151 -0.477 . . . . 74.32 110.949 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.01 -42.95 81.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.169 -0.469 . . . . 74.22 111.075 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 11.1 tt0 -70.45 -42.98 70.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.259 -0.428 . . . . 73.12 110.911 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -65.8 -31.53 72.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.141 -0.482 . . . . 72.4 110.88 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -62.26 -36.1 80.99 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.185 -0.461 . . . . 75.11 110.873 -179.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.0 mt -70.43 -21.07 62.86 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.127 -0.488 . . . . 75.43 110.935 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 4.6 ptmt -74.59 -31.21 61.97 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.216 -0.447 . . . . 75.45 110.909 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.4 ptp180 -86.65 -27.45 23.78 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.227 -0.442 . . . . 74.22 110.89 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -60.78 -13.06 12.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 75.2 110.835 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -120.45 -65.95 1.1 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.131 -0.486 . . . . 74.4 110.959 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 25.3 mt -157.48 -78.39 0.08 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.167 -0.469 . . . . 75.43 110.866 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -176.9 89.9 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.218 -0.447 . . . . 71.41 110.881 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -99.86 90.41 4.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.137 -0.483 . . . . 74.25 110.907 179.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.1 -35.07 22.03 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.21 -0.45 . . . . 62.15 110.825 -179.773 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -80.8 -21.39 40.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.202 -0.454 . . . . 74.51 110.892 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 59.9 m -76.88 -18.16 58.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.17 -0.468 . . . . 72.53 111.102 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 4.9 tttt -56.31 100.26 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.269 -0.423 . . . . 74.12 110.853 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -166.31 160.38 15.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.191 -0.458 . . . . 74.52 110.877 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.31 -35.45 63.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.118 -0.492 . . . . 71.02 111.15 179.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -78.19 -45.86 22.01 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.165 -0.47 . . . . 71.33 110.867 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.61 -27.83 68.02 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.195 -0.457 . . . . 74.02 110.83 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.3 tt -57.89 -37.94 74.91 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.134 -0.485 . . . . 74.54 110.887 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.72 -48.37 74.9 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.191 -0.458 . . . . 73.13 110.92 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.28 -48.52 76.45 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.128 -0.487 . . . . 71.12 111.136 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.9 -38.64 83.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.234 -0.439 . . . . 74.43 110.856 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.1 mp -54.58 -36.59 64.56 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.242 -0.435 . . . . 74.44 110.859 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.35 -45.68 87.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.173 -0.467 . . . . 74.2 110.907 179.836 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -69.7 -34.81 74.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.211 -0.45 . . . . 75.11 110.917 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.51 -47.04 68.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.107 -0.497 . . . . 63.43 110.909 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -58.57 -44.24 89.7 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.246 -0.434 . . . . 75.32 110.869 -179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.5 mmpt? -68.26 -29.99 68.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.175 -0.466 . . . . 75.11 110.904 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 30.0 t80 -69.98 -35.39 74.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.182 -0.463 . . . . 73.32 110.903 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -79.57 -29.77 41.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.162 -0.472 . . . . 70.43 110.825 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.42 ' HA2' ' HB2' ' A' ' 206' ' ' SER . . . 104.74 -10.56 49.1 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.694 -0.765 . . . . 64.42 112.536 -179.921 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.41 HD13 HG13 ' A' ' 50' ' ' ILE . 0.8 OUTLIER -67.27 139.34 94.8 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.683 0.754 . . . . 74.31 110.865 -179.86 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.71 -52.69 0.31 Allowed 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.705 2.27 . . . . 74.5 112.351 179.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.41 HG13 HD13 ' A' ' 48' ' ' LEU . 0.6 OUTLIER -49.24 108.1 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.212 -0.449 . . . . 72.24 111.133 179.939 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 1.5 t -107.01 163.68 12.77 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.198 -0.456 . . . . 73.25 111.131 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 60.82 17.02 49.06 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.747 -0.74 . . . . 64.24 112.465 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -114.13 161.13 18.16 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.852 0.358 . . . . 75.23 110.899 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 55.5 tp -173.29 85.1 0.05 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.23 -0.441 . . . . 74.32 110.929 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 172.44 -27.1 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.241 -0.436 . . . . 61.31 110.917 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 2.5 p -88.8 -97.14 0.09 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.224 -0.444 . . . . 75.25 110.875 -179.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.6 tpt180 -85.04 -32.38 22.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.146 -0.479 . . . . 74.13 110.89 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 69.1 t -60.14 -45.47 95.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.225 -0.443 . . . . 72.2 111.166 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -69.73 -31.32 48.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.168 -0.469 . . . . 75.2 111.113 179.881 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -59.36 -34.15 72.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.227 -0.442 . . . . 73.45 110.917 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -78.52 -30.03 15.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.108 -0.496 . . . . 74.52 111.121 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 5.2 mtt -63.11 -38.23 90.36 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.117 -0.492 . . . . 74.01 110.908 179.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -82.27 -23.14 35.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.147 -0.479 . . . . 45.15 110.927 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 27.5 mttm -85.34 140.77 36.5 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.638 0.732 . . . . 75.32 110.837 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.82 157.69 59.41 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.632 2.221 . . . . 72.11 112.361 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 34.5 ttp180 -155.18 -82.24 0.07 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.255 -0.429 . . . . 73.22 110.825 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -145.14 156.26 43.78 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.229 -0.441 . . . . 72.31 110.847 -179.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.556 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -101.31 17.55 55.43 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.814 -0.708 . . . . 64.23 112.571 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.403 ' CG1' ' HD2' ' A' ' 70' ' ' PRO . 0.0 OUTLIER -109.19 143.49 27.79 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 121.732 0.777 . . . . 74.23 111.101 -179.95 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . 0.403 ' HD2' ' CG1' ' A' ' 69' ' ' VAL . 53.2 Cg_endo -69.82 163.76 37.1 Favored 'Trans proline' 0 C--N 1.342 0.237 0 C-N-CA 122.713 2.275 . . . . 63.44 112.274 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 54.6 m-20 -112.53 33.79 4.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.152 -0.476 . . . . 74.45 110.822 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 1.8 m -137.55 129.42 40.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.224 -0.443 . . . . 73.52 111.229 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -131.02 170.71 14.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.174 -0.466 . . . . 73.13 111.058 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -138.49 173.07 11.98 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.165 -0.47 . . . . 74.13 110.824 -179.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -48.12 158.36 0.25 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.127 -0.488 . . . . 71.51 110.964 -179.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -50.96 122.11 7.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.222 -0.445 . . . . 74.2 110.885 -179.823 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.405 ' C ' ' CG ' ' A' ' 78' ' ' PHE . 2.2 mt -91.32 -24.62 19.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 70.34 110.811 -179.879 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . 0.656 ' HB2' ' HD3' ' A' ' 79' ' ' PRO . 0.2 OUTLIER -153.59 -59.37 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.665 0.745 . . . . 71.24 110.877 179.954 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.656 ' HD3' ' HB2' ' A' ' 78' ' ' PHE . 53.2 Cg_endo -69.83 175.48 8.1 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.672 2.248 . . . . 73.34 112.325 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 23.6 m120 -109.83 138.71 45.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.215 -0.448 . . . . 74.43 110.847 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 64.91 149.44 0.11 Allowed Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.681 0.753 . . . . 70.4 110.83 -179.852 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.72 -5.73 16.88 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.715 2.276 . . . . 72.25 112.382 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -119.8 -168.07 1.54 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.226 -0.443 . . . . 72.53 110.903 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 58.1 m95 -76.14 140.01 41.56 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.205 -0.452 . . . . 73.31 110.887 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 11.4 t -114.67 -23.64 9.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.224 -0.443 . . . . 71.34 111.147 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -55.05 150.29 10.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.25 -0.432 . . . . 73.12 110.84 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 35.9 mmtt -64.86 -29.81 70.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.105 -0.498 . . . . 71.12 110.898 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -148.63 138.15 15.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 74.14 111.147 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 85.1 t -114.91 130.45 69.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.454 . . . . 72.25 111.118 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 28.6 p -115.91 168.09 10.37 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.155 -0.475 . . . . 75.51 111.125 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 4.2 p90 -146.48 146.78 30.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.163 -0.471 . . . . 70.51 110.888 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 4.4 ttt180 -149.0 138.11 21.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.113 -0.494 . . . . 74.3 110.884 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.3 mm -76.48 135.3 27.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.223 -0.444 . . . . 72.4 111.147 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.484 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 17.9 t -91.14 -40.36 12.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.184 -0.462 . . . . 74.41 111.143 179.819 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 25.9 p -142.22 169.49 17.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.127 -0.488 . . . . 64.24 110.855 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 5.2 p90 -115.14 150.74 35.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.124 -0.489 . . . . 74.1 110.889 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' THR . . . . . 0.456 ' O ' ' O ' ' A' ' 100' ' ' LEU . 0.2 OUTLIER -83.05 141.05 32.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.083 -0.508 . . . . 75.33 111.139 -179.996 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 3.7 mtt-85 -73.0 -8.28 55.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.215 -0.448 . . . . 72.14 110.908 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -96.53 -26.0 15.43 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.148 -0.478 . . . . 74.13 110.893 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.456 ' O ' ' O ' ' A' ' 97' ' ' THR . 0.8 OUTLIER -135.91 153.51 77.11 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.676 0.75 . . . . 72.52 110.882 -179.904 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . 0.417 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.5 Cg_endo -69.76 150.91 68.82 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.684 2.256 . . . . 73.11 112.309 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 6.4 t-160 -53.34 -25.55 15.62 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.102 -0.499 . . . . 74.11 110.852 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.417 HG22 ' HB2' ' A' ' 101' ' ' PRO . 13.2 tt -76.54 -38.37 31.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.239 -0.437 . . . . 74.02 111.13 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 2.9 m -69.14 -40.59 78.15 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.193 -0.458 . . . . 54.24 111.161 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 55.9 t -72.92 -46.06 53.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 73.13 111.146 179.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.598 ' O ' HG22 ' A' ' 109' ' ' VAL . 60.5 t0 -61.5 -44.9 96.24 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.142 -0.481 . . . . 63.44 110.94 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -70.03 -33.41 71.95 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.161 -0.472 . . . . 75.02 110.87 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.532 ' HB3' ' HD2' ' A' ' 188' ' ' PHE . 0.0 OUTLIER -60.26 -49.27 78.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.451 . . . . 75.05 110.926 -179.94 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.598 HG22 ' O ' ' A' ' 106' ' ' ASP . 1.5 m -55.3 -42.05 64.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.206 -0.452 . . . . 72.31 111.18 179.79 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.469 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 43.2 t -70.22 -33.45 71.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.138 -0.483 . . . . 72.14 110.804 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -61.46 -33.05 73.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.15 -0.477 . . . . 74.35 110.853 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.75 -40.15 9.11 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.262 -0.426 . . . . 74.32 111.135 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.98 -33.63 76.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.216 -0.447 . . . . 74.11 110.891 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -65.6 -35.65 81.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.205 -0.452 . . . . 75.15 110.925 179.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' MET . . . . . 0.456 ' O ' ' HG3' ' A' ' 118' ' ' LYS . 0.0 OUTLIER -66.3 -31.95 73.07 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.13 -0.487 . . . . 74.0 110.913 179.892 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' TRP . . . . . 0.414 ' O ' HG12 ' A' ' 120' ' ' ILE . 8.7 m95 -73.98 -45.22 51.45 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.27 -0.423 . . . . 75.23 110.861 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -66.05 -44.75 90.8 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.775 -0.726 . . . . 73.44 112.464 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . 0.456 ' HG3' ' O ' ' A' ' 115' ' ' MET . 0.0 OUTLIER -61.97 -17.38 56.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.702 0.287 . . . . 74.42 110.865 -179.943 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.446 ' HB3' HG21 ' A' ' 231' ' ' ILE . 34.5 mm-40 -91.32 2.26 56.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.244 -0.435 . . . . 75.55 110.847 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.414 HG12 ' O ' ' A' ' 116' ' ' TRP . 6.0 pt -139.29 150.61 64.9 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.659 0.743 . . . . 71.34 111.094 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 6.35 1.34 Allowed 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.699 2.266 . . . . 75.35 112.43 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.426 ' HB3' ' H ' ' A' ' 123' ' ' HIS . 11.3 mt -60.96 -161.11 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.129 -0.487 . . . . 73.22 110.986 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.426 ' H ' ' HB3' ' A' ' 122' ' ' LEU . 3.5 t60 -151.03 122.48 7.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.24 -0.436 . . . . 74.12 110.858 179.893 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 10.6 m-30 -109.51 148.41 31.25 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.173 -0.467 . . . . 75.54 110.899 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.14 141.9 48.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.117 -0.492 . . . . 75.14 110.848 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.8 147.58 30.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.152 -0.476 . . . . 74.04 110.934 -179.977 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 30.1 m -103.25 126.29 57.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.26 -0.427 . . . . 50.13 111.162 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -142.52 -9.89 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.205 -0.452 . . . . 74.43 111.154 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -155.75 109.08 2.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.116 -0.493 . . . . 73.32 110.87 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.15 -159.96 14.38 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.748 -0.739 . . . . 62.11 112.502 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.8 156.21 17.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.842 0.354 . . . . 71.11 111.116 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -111.83 165.1 12.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.191 -0.459 . . . . 72.32 111.081 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -67.66 -55.8 11.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.231 -0.441 . . . . 75.41 110.885 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 31.6 mt -92.4 133.04 35.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.223 -0.444 . . . . 71.04 111.167 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' MET . . . . . 0.484 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 14.7 mmm -111.23 124.48 52.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.226 -0.443 . . . . 72.43 110.875 179.821 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -107.06 91.22 1.7 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.147 -0.479 . . . . 70.04 111.107 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -132.38 164.25 23.9 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.736 -0.745 . . . . 63.34 112.507 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 46.2 m-85 -105.67 144.28 32.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.793 0.33 . . . . 74.01 110.86 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . 175.15 167.03 0.3 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.143 -0.48 . . . . 71.21 111.033 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 20.8 mtm105 -104.36 173.62 6.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.192 -0.458 . . . . 72.34 110.88 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -56.06 -17.1 15.47 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.734 -0.746 . . . . 74.24 112.547 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -83.5 3.48 32.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.812 0.339 . . . . 75.03 111.118 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 7.2 p80 -69.85 -30.39 67.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.236 -0.438 . . . . 73.45 110.848 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 144.51 41.03 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.747 -0.74 . . . . 60.43 112.462 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 55.4 p-10 -146.64 162.22 38.91 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.839 0.352 . . . . 72.14 110.89 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 51.0 m -81.65 -179.9 7.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.151 -0.477 . . . . 64.54 110.888 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 64.65 123.68 0.02 OUTLIER Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.684 0.754 . . . . 73.4 110.937 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.83 146.19 58.98 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.717 2.278 . . . . 74.53 112.344 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 149' ' ' PHE . . . . . 0.415 ' CE1' ' HB2' ' A' ' 173' ' ' ASP . 0.1 OUTLIER -90.81 -33.19 15.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.21 -0.45 . . . . 70.0 110.882 -179.952 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 73.87 -1.76 2.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.111 -0.495 . . . . 72.24 110.847 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . 0.652 ' O ' 'CA ' ' A' ' 302' ' ' ' CA' . . . 51.88 -111.83 1.64 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.762 -0.732 . . . . 75.42 112.459 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.82 139.59 40.39 Favored 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.68 2.254 . . . . 75.11 112.333 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 103.14 -153.14 18.12 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.757 -0.735 . . . . 70.32 112.452 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 154' ' ' ASN . . . . . 0.415 ' O ' ' CB ' ' A' ' 155' ' ' THR . 4.6 p30 -40.81 152.04 0.05 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.913 0.387 . . . . 74.45 110.891 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 155' ' ' THR . . . . . 0.415 ' CB ' ' O ' ' A' ' 154' ' ' ASN . 1.4 m 78.34 110.81 0.07 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.189 -0.46 . . . . 63.14 111.112 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . 0.45 HD13 HG13 ' A' ' 186' ' ' ILE . 0.7 OUTLIER -92.25 -52.57 4.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.223 -0.444 . . . . 75.02 110.892 179.959 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . 0.556 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -166.81 148.12 6.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.246 -0.434 . . . . 73.44 111.087 179.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 24.6 p-80 -106.46 125.58 51.17 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.254 -0.43 . . . . 74.34 110.888 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -111.0 154.82 23.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 74.42 111.079 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 18.1 m-85 -104.21 150.09 24.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.183 -0.462 . . . . 75.31 110.842 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -77.67 162.64 67.47 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 121.573 0.701 . . . . 71.14 111.122 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.68 77.51 1.04 Allowed 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.658 2.239 . . . . 74.44 112.369 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -132.56 124.71 3.94 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.736 -0.745 . . . . 72.32 112.441 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 9.6 p 50.95 -170.72 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.856 0.36 . . . . 73.1 111.172 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -76.1 -57.51 4.0 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.775 -0.726 . . . . 74.03 112.479 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 7.7 tt -54.37 -39.69 67.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.853 0.358 . . . . 75.02 110.927 -179.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -81.01 153.63 34.43 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.693 -0.765 . . . . 43.43 112.446 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 95.12 23.02 21.19 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.747 -0.739 . . . . 74.31 112.537 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 82.4 m-20 -92.14 173.29 7.9 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.825 0.345 . . . . 63.41 110.88 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -118.2 130.63 56.2 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.166 -0.47 . . . . 74.21 111.114 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 16.8 m170 -128.66 132.58 48.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.207 -0.451 . . . . 72.53 110.924 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 172' ' ' PHE . . . . . 0.406 ' HA ' ' HB2' ' A' ' 157' ' ' ALA . 42.9 m-85 -116.35 140.16 49.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.253 -0.431 . . . . 71.44 110.902 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 173' ' ' ASP . . . . . 0.415 ' HB2' ' CE1' ' A' ' 149' ' ' PHE . 68.0 t0 -69.22 96.85 0.87 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.117 -0.492 . . . . 74.11 110.778 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 2.6 pp20? -56.42 -17.95 9.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.222 -0.445 . . . . 74.45 110.886 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -79.55 -20.46 47.04 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.117 -0.492 . . . . 73.32 110.944 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 30.0 mm-40 -77.88 -172.4 2.66 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.16 -0.473 . . . . 71.41 110.926 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 20.2 ptt180 -115.03 115.28 26.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.172 -0.467 . . . . 74.32 110.841 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 53.6 m95 -116.95 142.9 46.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.155 -0.475 . . . . 74.32 110.898 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 12.2 t -178.16 163.61 1.71 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.252 -0.431 . . . . 74.13 111.156 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -125.28 -68.9 0.82 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.209 -0.45 . . . . 61.52 110.896 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -63.99 -12.99 51.35 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.762 -0.732 . . . . 62.41 112.515 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -93.34 -24.41 18.12 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.852 0.358 . . . . 74.0 110.81 -179.712 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 86.9 p 38.27 42.96 0.56 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.185 -0.461 . . . . 64.12 110.839 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 2.3 tt -106.92 -33.42 7.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.126 -0.488 . . . . 74.43 110.913 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -113.11 -145.46 9.38 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.69 -0.767 . . . . 74.22 112.428 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 186' ' ' ILE . . . . . 0.45 HG13 HD13 ' A' ' 156' ' ' LEU . 10.6 mm -78.93 97.77 2.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.875 0.369 . . . . 73.22 111.11 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -44.23 115.21 0.8 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.178 -0.464 . . . . 71.31 110.85 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 188' ' ' PHE . . . . . 0.532 ' HD2' ' HB3' ' A' ' 108' ' ' LEU . 1.4 t80 -53.88 -33.64 57.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.199 -0.455 . . . . 75.45 110.912 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.07 -48.25 68.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.098 -0.501 . . . . 60.14 110.922 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.23 -39.77 74.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.151 -0.477 . . . . 74.22 110.938 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -69.87 -34.9 74.18 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.171 -0.468 . . . . 61.32 111.047 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 192' ' ' ALA . . . . . 0.445 ' O ' ' HB2' ' A' ' 196' ' ' LEU . . . -56.38 -44.61 80.36 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.247 -0.433 . . . . 52.32 111.1 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.77 -43.62 90.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 72.43 111.182 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 15.7 t-160 -72.9 -38.0 67.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.218 -0.446 . . . . 71.44 110.872 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -74.63 -47.38 32.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.201 -0.454 . . . . 71.01 111.117 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 196' ' ' LEU . . . . . 0.47 HD22 ' N ' ' A' ' 196' ' ' LEU . 4.6 mm? -63.08 -45.78 90.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.259 -0.428 . . . . 74.52 110.906 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -54.86 -29.47 50.67 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.731 -0.747 . . . . 62.43 112.506 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 198' ' ' HIS . . . . . . . . . . . . . 6.4 m-70 -66.6 -35.89 81.28 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.887 0.375 . . . . 75.21 110.889 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 13.0 t -68.05 -21.28 65.01 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.171 -0.468 . . . . 73.13 110.877 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -89.55 -7.45 54.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.141 -0.481 . . . . 75.12 110.881 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 89.73 9.58 66.12 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.715 -0.755 . . . . 50.41 112.459 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 202' ' ' MET . . . . . . . . . . . . . 18.1 tpp -72.85 135.08 45.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.797 0.332 . . . . 71.04 110.92 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -101.34 159.11 18.71 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.799 -0.715 . . . . 64.44 112.453 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 11.2 m170 -54.77 163.04 1.04 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.736 0.303 . . . . 74.32 110.895 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -124.39 153.93 41.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.255 -0.429 . . . . 72.42 110.912 -179.878 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 206' ' ' SER . . . . . 0.42 ' HB2' ' HA2' ' A' ' 47' ' ' GLY . 7.9 p -88.2 -4.68 58.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.09 -0.504 . . . . 72.22 110.87 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.55 137.51 83.39 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.535 0.683 . . . . 65.11 110.882 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.74 -7.38 20.9 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.628 2.218 . . . . 74.53 112.383 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -125.48 29.32 6.04 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.132 -0.485 . . . . 63.52 110.867 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 210' ' ' ALA . . . . . 0.462 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.24 145.38 26.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.183 -0.462 . . . . 64.4 111.14 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -73.47 -25.14 20.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.218 -0.446 . . . . 75.23 111.143 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 35.3 mmm -95.24 9.52 39.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.451 . . . . 75.22 110.826 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 213' ' ' TYR . . . . . 0.414 ' HB2' ' O ' ' A' ' 210' ' ' ALA . 0.2 OUTLIER -55.59 126.7 64.65 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-O 121.633 0.73 . . . . 73.43 110.926 -179.895 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 214' ' ' PRO . . . . . 0.408 ' HD2' ' CD1' ' A' ' 213' ' ' TYR . 54.1 Cg_endo -69.69 -18.54 37.3 Favored 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.69 2.26 . . . . 63.01 112.313 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 18.6 p -99.85 66.97 1.42 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.213 -0.449 . . . . 74.24 111.052 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -41.2 122.66 1.87 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.222 -0.445 . . . . 74.42 110.877 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -77.71 172.39 55.16 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.745 -0.74 . . . . 74.22 112.51 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 12.4 t-20 -105.45 -22.35 13.03 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.864 0.364 . . . . 64.22 110.929 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . -51.58 155.35 3.96 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.728 -0.748 . . . . 73.55 112.52 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 220' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -119.86 101.23 48.09 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 121.605 0.717 . . . . 73.41 110.976 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 168.69 20.8 Favored 'Trans proline' 0 C--O 1.231 0.148 0 C-N-CA 122.691 2.261 . . . . 74.21 112.352 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -75.49 -45.69 36.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.24 -0.437 . . . . 75.43 110.884 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -130.84 -40.83 1.18 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.214 -0.448 . . . . 70.33 110.859 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER 63.93 126.99 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.157 -0.474 . . . . 71.11 110.855 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.7 -170.8 3.39 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.124 -0.489 . . . . 65.02 110.931 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . 0.423 ' HG ' ' HG3' ' A' ' 119' ' ' GLU . 0.9 OUTLIER -59.18 148.93 29.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.258 -0.428 . . . . 62.53 110.922 179.885 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 227' ' ' SER . . . . . 0.462 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 1.9 t -86.73 156.31 20.0 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.14 -0.482 . . . . 74.21 110.889 -179.936 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.71 -63.5 1.24 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.178 -0.464 . . . . 74.54 110.948 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 49.3 t0 -55.66 -27.47 50.16 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.233 -0.44 . . . . 74.2 110.878 179.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.77 -48.24 59.98 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.196 -0.456 . . . . 74.23 110.841 -179.977 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 231' ' ' ILE . . . . . 0.446 HG21 ' HB3' ' A' ' 119' ' ' GLU . 12.8 mt -68.32 -43.82 84.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.237 -0.438 . . . . 73.41 111.203 179.924 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.71 -32.45 73.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.074 -0.512 . . . . 73.32 110.867 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -62.78 -49.8 69.59 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.795 -0.717 . . . . 65.45 112.513 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 18.9 tt -73.13 -32.27 38.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-O 120.803 0.335 . . . . 74.41 111.161 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -67.15 -29.19 68.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.112 -0.495 . . . . 71.13 110.86 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 236' ' ' LYS . . . . . 0.453 ' HE3' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.49 -24.21 58.98 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.2 -0.455 . . . . 74.41 110.903 179.935 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 237' ' ' LEU . . . . . 0.453 ' HB2' ' HE3' ' A' ' 236' ' ' LYS . 1.7 tt -97.58 -29.48 13.42 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.241 -0.436 . . . . 75.41 110.949 179.906 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 238' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -91.91 -35.72 13.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.175 -0.466 . . . . 54.42 110.851 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -139.69 -119.4 1.65 Allowed Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.786 -0.721 . . . . 72.22 112.435 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 2.4 pttm -90.42 153.68 20.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.807 0.337 . . . . 75.42 110.872 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 9.8 ptt-85 -90.79 -172.35 3.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.213 -0.449 . . . . 73.34 110.849 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 4.1 t -151.85 -66.26 0.17 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.203 -0.453 . . . . 62.43 110.906 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 13.8 t30 -178.4 90.2 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.155 -0.475 . . . . 72.13 110.896 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 1.2 p -177.12 160.46 1.76 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.152 -0.476 . . . . 71.41 110.854 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 4.0 mmm-85 -118.05 107.99 14.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.098 -0.501 . . . . 75.43 110.871 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -52.93 147.88 8.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.191 -0.458 . . . . 72.11 110.833 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 2.7 mtmt . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.176 -0.465 . . . . 74.13 110.952 179.798 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 302' ' ' ' CA' . . . . . 0.652 'CA ' ' O ' ' A' ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' -2' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.232 0.153 0 CA-C-O 121.598 0.713 . . . . 73.02 110.925 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' -1' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.91 114.7 3.81 Favored 'Trans proline' 0 C--O 1.232 0.199 0 C-N-CA 122.662 2.241 . . . . 73.21 112.308 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 37.1 mt -142.47 71.06 21.34 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-O 121.631 0.729 . . . . 75.23 110.973 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.79 -48.37 0.73 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.71 2.273 . . . . 64.24 112.334 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -176.09 97.3 0.06 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.178 -0.464 . . . . 62.24 110.884 -179.957 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -95.44 -28.39 14.94 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.199 -0.455 . . . . 74.01 110.9 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.66 -34.1 67.01 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.13 -0.486 . . . . 71.4 111.122 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -55.97 -23.44 38.7 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.674 -0.774 . . . . 62.21 112.506 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -108.2 20.1 31.18 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.744 -0.741 . . . . 54.42 112.468 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 26.3 mmt -102.11 164.23 11.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.741 0.305 . . . . 72.23 110.906 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -113.61 168.8 9.46 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.23 -0.441 . . . . 73.24 110.862 -179.765 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 24.6 pt-20 -54.4 -31.99 56.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.161 -0.472 . . . . 73.44 110.876 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.64 -42.75 99.78 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.195 -0.457 . . . . 72.33 110.885 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -62.42 -42.97 99.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.188 -0.46 . . . . 72.14 110.864 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 15.8 t-105 -73.09 -33.22 65.48 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.201 -0.454 . . . . 71.22 110.926 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -73.17 -36.49 66.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.229 -0.442 . . . . 72.51 110.947 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -63.77 -36.78 85.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.106 -0.497 . . . . 74.32 110.922 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.6 -37.33 86.91 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.139 -0.482 . . . . 74.22 111.124 179.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -67.65 -43.02 81.27 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.238 -0.437 . . . . 73.12 110.861 -179.925 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -73.94 -32.42 63.49 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.201 -0.454 . . . . 72.4 110.891 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 3.5 m-30 -70.65 -36.28 73.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.134 -0.485 . . . . 75.11 110.906 -179.795 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -71.7 -21.02 61.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.118 -0.492 . . . . 75.43 110.9 179.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 5.2 ptmt -74.77 -32.99 62.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.248 -0.433 . . . . 75.45 110.899 179.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.23 -26.4 33.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.244 -0.435 . . . . 74.22 110.852 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -65.3 -7.64 14.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.217 -0.447 . . . . 75.2 110.934 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -113.85 -76.29 0.58 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.097 -0.501 . . . . 74.4 110.94 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 21.2 mt -160.45 29.82 0.16 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.1 -0.5 . . . . 75.43 110.938 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 5.6 t80 50.15 88.94 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.454 . . . . 71.41 110.908 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -125.9 124.95 41.98 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.089 -0.505 . . . . 74.25 110.867 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -84.99 -6.37 59.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.208 -0.451 . . . . 62.15 110.909 -179.818 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -74.4 -11.02 60.13 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.182 -0.463 . . . . 74.51 110.915 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 4.7 m -76.57 -2.29 31.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.152 -0.476 . . . . 72.53 111.122 -179.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.58 170.31 0.05 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.212 -0.449 . . . . 74.12 110.888 179.982 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 31.2 t-20 67.61 148.05 0.05 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.271 -0.422 . . . . 74.52 110.872 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.94 -26.35 59.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.145 -0.479 . . . . 71.02 111.109 179.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -51.96 -45.72 64.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.188 -0.46 . . . . 71.33 110.884 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -85.78 -19.84 30.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.188 -0.46 . . . . 74.02 110.832 -179.81 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.9 tt -61.51 -44.72 96.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.145 -0.48 . . . . 74.54 110.87 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -61.38 -48.78 79.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.242 -0.435 . . . . 73.13 110.893 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.79 -51.2 60.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.148 -0.478 . . . . 71.12 111.079 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.474 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.5 OUTLIER -59.78 -49.68 76.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.239 -0.437 . . . . 74.43 110.867 179.976 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.435 ' O ' ' HG2' ' A' ' 43' ' ' GLN . 0.1 OUTLIER -55.34 -37.51 67.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.267 -0.424 . . . . 74.44 110.952 179.884 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.51 -45.58 88.47 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.219 -0.446 . . . . 74.2 110.844 179.798 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.474 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 2.2 pt-20 -60.56 -32.7 71.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.288 -0.414 . . . . 75.11 110.902 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -68.35 -34.32 75.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.032 -0.531 . . . . 63.43 110.865 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.435 ' HG2' ' O ' ' A' ' 39' ' ' LEU . 4.9 mm-40 -58.35 -39.64 80.08 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.275 -0.42 . . . . 75.32 110.895 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.4 mmpt? -66.42 -28.73 68.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.22 -0.445 . . . . 75.11 110.935 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -70.49 -40.92 73.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.19 -0.459 . . . . 73.32 110.932 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -82.03 -35.53 28.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.126 -0.488 . . . . 70.43 110.881 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 101.99 -8.99 56.33 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.711 -0.756 . . . . 64.42 112.518 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.97 139.92 90.52 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.622 0.725 . . . . 74.31 110.922 -179.89 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.74 -52.49 0.32 Allowed 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.651 2.234 . . . . 74.5 112.353 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -52.15 108.06 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.271 -0.422 . . . . 72.24 111.167 179.868 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.425 ' HA ' ' HG3' ' A' ' 43' ' ' GLN . 66.2 p -105.34 156.35 18.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.206 -0.452 . . . . 73.25 111.173 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 58.67 18.21 37.44 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.795 -0.716 . . . . 64.24 112.473 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -113.17 161.1 17.54 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.767 0.318 . . . . 75.23 110.887 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.418 ' HA ' ' HB ' ' A' ' 58' ' ' VAL . 25.8 tp -164.78 93.98 0.66 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.223 -0.444 . . . . 74.32 110.936 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 178.18 -30.91 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.157 -0.474 . . . . 61.31 110.855 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 29.7 t -89.65 -102.24 0.09 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.175 -0.466 . . . . 75.25 110.919 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 65.9 mtt-85 -84.81 -27.13 27.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.184 -0.462 . . . . 74.13 110.953 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.443 ' O ' ' CG1' ' A' ' 61' ' ' ILE . 84.2 t -65.62 -40.77 88.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.09 -0.504 . . . . 72.2 111.125 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -76.85 -31.43 19.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.214 -0.448 . . . . 75.2 111.145 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -65.02 -44.99 87.33 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.164 -0.471 . . . . 73.45 110.836 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.443 ' CG1' ' O ' ' A' ' 58' ' ' VAL . 14.9 pt -59.76 -29.63 43.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.163 -0.472 . . . . 74.52 111.148 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' MET . . . . . 0.435 ' HG2' ' O ' ' A' ' 58' ' ' VAL . 9.7 mmm -60.64 -39.19 87.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.17 -0.468 . . . . 74.01 110.821 179.857 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -93.81 -25.64 17.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.265 -0.425 . . . . 45.15 110.905 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.69 118.35 71.53 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.605 0.717 . . . . 75.32 110.868 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.76 126.29 13.14 Favored 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.683 2.255 . . . . 72.11 112.371 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -121.29 -74.99 0.6 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.169 -0.469 . . . . 73.22 110.862 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 2.8 p -140.72 148.2 40.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.149 -0.478 . . . . 72.31 110.855 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.583 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -93.9 13.88 66.48 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.701 -0.761 . . . . 64.23 112.495 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -101.75 137.49 19.57 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.67 0.748 . . . . 74.23 111.073 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.83 159.12 54.53 Favored 'Trans proline' 0 C--O 1.231 0.153 0 C-N-CA 122.677 2.251 . . . . 63.44 112.33 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -94.53 4.91 53.24 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.198 -0.456 . . . . 74.45 110.813 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -140.83 129.82 25.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.272 -0.422 . . . . 73.52 111.126 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -130.98 170.42 14.5 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.122 -0.49 . . . . 73.13 111.138 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -158.03 120.07 3.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.27 -0.423 . . . . 74.13 110.861 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -170.42 94.38 0.22 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.113 -0.494 . . . . 71.51 110.933 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -55.95 177.21 0.06 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.173 -0.467 . . . . 74.2 110.8 -179.814 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 51.32 33.44 9.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.125 -0.489 . . . . 70.34 110.912 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 33.1 p90 -51.55 153.22 4.07 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.665 0.745 . . . . 71.24 110.85 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.78 -175.13 1.06 Allowed 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.689 2.259 . . . . 73.34 112.343 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 65.3 m-20 -64.27 97.43 0.19 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 74.43 110.851 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 63.57 157.51 0.12 Allowed Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.713 0.768 . . . . 70.4 110.781 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.75 -49.45 0.56 Allowed 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.702 2.268 . . . . 72.25 112.316 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 5.1 mttp -74.05 164.98 25.94 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.257 -0.428 . . . . 72.53 110.914 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . 0.493 ' CD1' ' HA ' ' A' ' 200' ' ' LEU . 19.6 m95 -52.86 132.5 37.05 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.248 -0.433 . . . . 73.31 110.87 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 5.6 t -115.08 -15.0 11.77 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.19 -0.459 . . . . 71.34 111.084 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -62.48 165.0 6.65 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.302 -0.408 . . . . 73.12 110.893 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.22 -30.26 38.59 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.165 -0.47 . . . . 71.12 110.909 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 1.1 p -148.12 137.84 16.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.214 -0.448 . . . . 74.14 111.174 179.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 97.2 t -119.1 138.66 49.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.158 -0.474 . . . . 72.25 111.141 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 7.5 p -115.87 168.07 10.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.157 -0.474 . . . . 75.51 111.088 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 6.5 p90 -147.08 147.08 30.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.15 -0.477 . . . . 70.51 110.979 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -146.85 136.39 22.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.136 -0.484 . . . . 74.3 110.847 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.426 HD13 ' HB ' ' A' ' 136' ' ' ILE . 16.4 mm -76.05 135.26 27.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.121 -0.49 . . . . 72.4 111.144 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.499 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 21.2 t -88.15 -40.68 13.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.191 -0.459 . . . . 74.41 111.128 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 4.3 t -153.74 158.88 41.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.178 -0.465 . . . . 64.24 110.951 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 10.5 p90 -106.1 147.71 28.64 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.248 -0.433 . . . . 74.1 110.902 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' THR . . . . . 0.539 ' O ' ' O ' ' A' ' 100' ' ' LEU . 0.3 OUTLIER -81.71 140.76 34.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.137 -0.483 . . . . 75.33 111.183 179.961 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -62.18 -15.98 49.95 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.244 -0.434 . . . . 72.14 110.834 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -91.16 -25.33 19.62 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.225 -0.443 . . . . 74.13 110.902 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.539 ' O ' ' O ' ' A' ' 97' ' ' THR . 18.4 mt -131.69 140.02 37.02 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.515 0.674 . . . . 72.52 110.928 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . 0.466 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.3 Cg_endo -69.8 150.87 68.53 Favored 'Trans proline' 0 C--O 1.232 0.218 0 C-N-CA 122.653 2.235 . . . . 73.11 112.309 179.872 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 3.1 t-160 -49.27 -29.99 6.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.226 -0.443 . . . . 74.11 110.823 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.466 HG22 ' HB2' ' A' ' 101' ' ' PRO . 16.6 tt -72.7 -43.16 61.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.214 -0.448 . . . . 74.02 111.136 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' THR . . . . . 0.408 ' CG2' HD23 ' A' ' 108' ' ' LEU . 2.3 m -69.63 -38.13 77.06 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.132 -0.485 . . . . 54.24 111.118 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 75.5 t -72.87 -44.61 57.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.226 -0.443 . . . . 73.13 111.096 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.565 ' O ' HG21 ' A' ' 109' ' ' VAL . 29.7 t70 -62.95 -43.22 99.39 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.216 -0.447 . . . . 63.44 110.87 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -70.13 -33.25 71.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.205 -0.452 . . . . 75.02 110.846 -179.839 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.452 ' HB3' ' HD2' ' A' ' 188' ' ' PHE . 0.0 OUTLIER -60.18 -47.59 85.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.164 -0.471 . . . . 75.05 110.9 -179.957 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.565 HG21 ' O ' ' A' ' 106' ' ' ASP . 1.4 m -55.2 -41.46 60.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.161 -0.472 . . . . 72.31 111.171 179.843 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.477 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 42.5 t -70.56 -33.64 71.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.169 -0.469 . . . . 72.14 110.858 -179.857 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -61.59 -33.1 73.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.099 -0.5 . . . . 74.35 110.879 179.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.56 -40.28 9.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.193 -0.458 . . . . 74.32 111.066 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.424 HD13 HD13 ' A' ' 196' ' ' LEU . 0.3 OUTLIER -65.59 -33.62 76.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.181 -0.463 . . . . 74.11 110.913 -179.95 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 44.2 t30 -69.64 -38.23 77.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.181 -0.463 . . . . 75.15 110.899 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.42 -34.23 73.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.138 -0.483 . . . . 74.0 110.865 179.897 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 14.5 m95 -70.23 -50.09 43.42 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.243 -0.435 . . . . 75.23 110.928 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . 0.432 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -66.34 -36.42 91.63 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.781 -0.724 . . . . 73.44 112.529 179.872 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 43.2 mtmt -61.66 -16.52 49.45 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.706 0.289 . . . . 74.42 110.838 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.406 ' HG3' HG12 ' A' ' 231' ' ' ILE . 71.3 mm-40 -101.32 13.42 35.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.276 -0.42 . . . . 75.55 110.875 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.432 ' CG1' ' HA2' ' A' ' 117' ' ' GLY . 5.3 pt -148.26 152.18 38.69 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.656 0.741 . . . . 71.34 111.134 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.66 4.7 1.99 Allowed 'Trans proline' 0 C--O 1.232 0.212 0 C-N-CA 122.718 2.279 . . . . 75.35 112.387 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.414 ' HB3' ' H ' ' A' ' 123' ' ' HIS . 10.2 mt -60.72 -158.34 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.243 -0.435 . . . . 73.22 110.936 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.414 ' H ' ' HB3' ' A' ' 122' ' ' LEU . 4.3 t60 -161.7 140.69 9.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.144 -0.48 . . . . 74.12 110.809 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 37.9 m-85 -125.0 148.41 48.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.192 -0.458 . . . . 75.54 110.875 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.38 141.09 52.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.154 -0.476 . . . . 75.14 110.854 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.98 139.87 35.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.217 -0.447 . . . . 74.04 110.927 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 17.3 m -102.81 131.97 49.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.151 -0.477 . . . . 50.13 111.15 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -144.41 -23.14 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.219 -0.446 . . . . 74.43 111.132 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -138.77 109.1 6.47 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.188 -0.46 . . . . 73.32 110.896 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 108.18 -159.84 14.12 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.714 -0.755 . . . . 62.11 112.501 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -101.89 155.66 18.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.792 0.33 . . . . 71.11 111.15 -179.877 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -112.22 165.24 12.34 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.181 -0.463 . . . . 72.32 111.088 179.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -67.44 -62.8 1.24 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.181 -0.463 . . . . 75.41 110.895 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 45.5 mt -87.67 139.8 16.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.227 -0.442 . . . . 71.04 111.163 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' MET . . . . . 0.499 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 16.4 mmm -114.33 130.19 56.66 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.2 -0.455 . . . . 72.43 110.904 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.426 ' HB ' HD13 ' A' ' 93' ' ' ILE . 0.3 OUTLIER -111.17 88.15 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.3 -0.409 . . . . 70.04 111.119 179.969 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -134.11 157.27 22.78 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.673 -0.775 . . . . 63.34 112.389 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 31.2 p90 -105.43 151.62 24.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.886 0.374 . . . . 74.01 110.871 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.446 ' CA ' ' HB2' ' A' ' 174' ' ' GLU . . . 169.64 168.81 0.05 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.197 -0.456 . . . . 71.21 111.089 179.901 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 18.1 mtp180 -102.64 172.87 6.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.18 -0.463 . . . . 72.34 110.849 -179.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -54.03 -17.43 7.43 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.707 -0.759 . . . . 74.24 112.54 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -85.58 13.09 7.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.865 0.364 . . . . 75.03 111.188 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . 0.412 ' HB3' ' HB2' ' A' ' 139' ' ' ALA . 5.1 p80 -85.91 1.91 48.12 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.21 -0.45 . . . . 73.45 110.864 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 106.07 38.47 2.31 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.764 -0.732 . . . . 60.43 112.465 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -139.71 176.47 8.71 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.844 0.354 . . . . 72.14 110.882 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 66.9 m -85.7 166.76 15.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.222 -0.445 . . . . 64.54 110.844 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 66.23 127.73 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.69 0.757 . . . . 73.4 110.89 -179.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.74 152.41 69.41 Favored 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.709 2.273 . . . . 74.53 112.408 179.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 149' ' ' PHE . . . . . 0.48 ' C ' ' H ' ' A' ' 151' ' ' GLY . 1.5 p90 -52.65 -25.58 11.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.26 -0.427 . . . . 70.0 110.887 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 75.97 -20.87 0.33 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.179 -0.464 . . . . 72.24 110.875 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . 0.48 ' H ' ' C ' ' A' ' 149' ' ' PHE . . . 81.44 -161.29 42.69 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.73 -0.748 . . . . 75.42 112.417 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.68 141.88 46.76 Favored 'Trans proline' 0 C--N 1.343 0.243 0 C-N-CA 122.683 2.255 . . . . 75.11 112.403 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 103.71 -133.29 11.4 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.746 -0.74 . . . . 70.32 112.497 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -37.34 148.31 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.943 0.401 . . . . 74.45 110.855 -179.847 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 59.6 m 65.72 115.11 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.142 -0.481 . . . . 63.14 111.108 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . 0.544 HD12 HG13 ' A' ' 186' ' ' ILE . 1.0 OUTLIER -103.9 -52.72 2.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.179 -0.464 . . . . 75.02 110.897 179.975 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . 0.583 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -153.76 148.27 26.16 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.235 -0.438 . . . . 73.44 111.073 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 26.3 p-80 -111.01 117.49 33.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.21 -0.45 . . . . 74.34 110.831 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -109.81 148.3 31.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.221 -0.445 . . . . 74.42 111.071 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 -104.06 169.5 8.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.172 -0.467 . . . . 75.31 110.836 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -104.42 161.47 22.77 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.575 0.703 . . . . 71.14 111.161 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.68 88.11 0.53 Allowed 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.724 2.283 . . . . 74.44 112.348 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -146.43 136.78 6.44 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.767 -0.73 . . . . 72.32 112.463 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 2.7 m 72.24 -69.2 0.19 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.82 0.343 . . . . 73.1 111.122 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . 160.44 -59.49 0.31 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.76 -0.733 . . . . 74.03 112.527 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 10.3 tt -54.07 -35.13 61.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.865 0.364 . . . . 75.02 110.944 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -74.28 -163.75 10.07 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.726 -0.75 . . . . 43.43 112.494 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 73.13 11.9 79.32 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.676 -0.773 . . . . 74.31 112.435 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 61.7 m-20 -91.51 171.38 9.23 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.829 0.347 . . . . 63.41 110.855 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -117.5 131.58 56.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.211 -0.45 . . . . 74.21 111.082 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 28.7 m170 -124.72 158.86 32.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.21 -0.45 . . . . 72.53 110.854 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 172' ' ' PHE . . . . . 0.432 ' HB3' ' CZ2' ' A' ' 178' ' ' TRP . 25.0 m-85 -134.03 143.99 48.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.183 -0.462 . . . . 71.44 110.896 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 173' ' ' ASP . . . . . 0.438 ' CB ' ' O ' ' A' ' 156' ' ' LEU . 49.1 t0 -71.07 103.28 2.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.109 -0.496 . . . . 74.11 110.829 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 174' ' ' GLU . . . . . 0.446 ' HB2' ' CA ' ' A' ' 139' ' ' ALA . 0.5 OUTLIER -58.27 -16.92 15.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.158 -0.474 . . . . 74.45 110.907 -179.939 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -77.85 -15.16 59.26 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.148 -0.478 . . . . 73.32 110.851 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -89.73 176.78 6.72 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.202 -0.454 . . . . 71.41 110.878 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 77.8 mtt180 -103.02 123.05 45.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.143 -0.481 . . . . 74.32 110.882 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 178' ' ' TRP . . . . . 0.433 ' CZ3' ' HB ' ' A' ' 186' ' ' ILE . 44.4 m95 -117.48 132.38 56.56 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.217 -0.447 . . . . 74.32 110.904 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 3.5 t -177.46 164.13 2.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.235 -0.439 . . . . 74.13 111.15 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -124.03 -68.77 0.85 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.211 -0.45 . . . . 61.52 110.818 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -66.15 -10.87 53.8 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.772 -0.728 . . . . 62.41 112.548 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 182' ' ' SER . . . . . 0.435 ' O ' ' C ' ' A' ' 183' ' ' SER . 0.2 OUTLIER -97.65 -24.34 15.56 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.887 0.375 . . . . 74.0 110.854 -179.766 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 183' ' ' SER . . . . . 0.435 ' C ' ' O ' ' A' ' 182' ' ' SER . 1.8 p 34.55 65.43 0.34 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.133 -0.485 . . . . 64.12 110.815 -179.838 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -117.1 -33.76 4.6 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.157 -0.474 . . . . 74.43 110.895 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -124.54 -136.33 4.6 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.797 -0.716 . . . . 74.22 112.508 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 186' ' ' ILE . . . . . 0.544 HG13 HD12 ' A' ' 156' ' ' LEU . 7.3 mm -79.21 105.88 9.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-O 120.872 0.368 . . . . 73.22 111.092 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -51.07 123.9 10.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.138 -0.483 . . . . 71.31 110.838 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 188' ' ' PHE . . . . . 0.452 ' HD2' ' HB3' ' A' ' 108' ' ' LEU . 4.3 t80 -53.6 -35.52 60.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.171 -0.468 . . . . 75.45 110.896 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . 0.448 HD23 HD12 ' A' ' 108' ' ' LEU . 0.1 OUTLIER -67.46 -47.38 70.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.113 -0.494 . . . . 60.14 110.915 -179.892 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -66.06 -37.55 86.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.159 -0.473 . . . . 74.22 110.948 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -72.54 -35.34 68.02 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.109 -0.496 . . . . 61.32 111.095 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 192' ' ' ALA . . . . . 0.487 ' O ' ' HB2' ' A' ' 196' ' ' LEU . . . -60.8 -44.62 96.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.235 -0.439 . . . . 52.32 111.04 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -58.1 -44.47 87.69 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.219 -0.446 . . . . 72.43 111.162 -179.884 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 2.8 t60 -72.58 -42.76 64.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.138 -0.483 . . . . 71.44 110.842 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -68.84 -47.23 66.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.233 -0.44 . . . . 71.01 111.114 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 196' ' ' LEU . . . . . 0.487 ' HB2' ' O ' ' A' ' 192' ' ' ALA . 4.5 mm? -63.13 -43.61 97.91 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.239 -0.437 . . . . 74.52 110.912 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -56.2 -29.29 56.02 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.707 -0.758 . . . . 62.43 112.522 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 198' ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -68.03 -40.32 82.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.864 0.364 . . . . 75.21 110.899 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.85 -21.17 62.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.17 -0.468 . . . . 73.13 110.828 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 200' ' ' LEU . . . . . 0.493 ' HA ' ' CD1' ' A' ' 84' ' ' TRP . 0.6 OUTLIER -90.44 2.75 55.35 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.147 -0.479 . . . . 75.12 110.915 179.992 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 83.71 -4.03 83.5 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.729 -0.748 . . . . 50.41 112.483 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 202' ' ' MET . . . . . . . . . . . . . 97.9 mmm -63.85 133.46 53.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.789 0.328 . . . . 71.04 110.877 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -101.48 -176.34 28.6 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.781 -0.724 . . . . 64.44 112.526 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 20.7 m-70 -73.84 144.34 45.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.798 0.332 . . . . 74.32 110.893 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -103.93 153.46 20.77 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.249 -0.432 . . . . 72.42 110.838 -179.776 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 6.5 p -87.79 -4.78 58.86 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.486 . . . . 72.22 110.814 -179.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.55 137.82 83.4 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.619 0.723 . . . . 65.11 110.881 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 -6.62 19.01 Favored 'Trans proline' 0 C--N 1.342 0.222 0 C-N-CA 122.682 2.254 . . . . 74.53 112.336 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -127.92 30.16 5.31 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.189 -0.46 . . . . 63.52 110.886 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 210' ' ' ALA . . . . . 0.465 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.22 145.51 26.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.194 -0.457 . . . . 64.4 111.132 179.851 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -68.35 -27.52 37.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.238 -0.437 . . . . 75.23 111.145 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -98.25 10.53 40.41 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.209 -0.451 . . . . 75.22 110.846 179.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 213' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -55.71 118.08 18.19 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.698 0.761 . . . . 73.43 110.909 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.82 -18.47 36.71 Favored 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 122.611 2.207 . . . . 63.01 112.363 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -84.79 49.97 1.82 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.174 -0.466 . . . . 74.24 111.172 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -57.02 124.22 17.93 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.202 -0.454 . . . . 74.42 110.925 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . 128.8 67.15 0.12 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.753 -0.736 . . . . 74.22 112.512 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -130.0 -74.78 0.54 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.901 0.381 . . . . 64.22 110.907 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . -136.08 171.76 22.65 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.766 -0.731 . . . . 73.55 112.536 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 220' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -120.31 101.52 46.66 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 121.625 0.726 . . . . 73.41 110.833 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.83 168.19 22.37 Favored 'Trans proline' 0 C--N 1.341 0.143 0 C-N-CA 122.732 2.288 . . . . 74.21 112.309 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -75.01 -44.96 45.11 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.182 -0.463 . . . . 75.43 110.909 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -127.3 -40.12 1.84 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.268 -0.424 . . . . 70.33 110.852 -179.924 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER 66.58 134.73 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.155 -0.475 . . . . 71.11 110.938 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -143.87 -167.9 2.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.087 -0.506 . . . . 65.02 110.919 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . 0.405 ' HG ' ' HG3' ' A' ' 119' ' ' GLU . 0.6 OUTLIER -59.56 149.2 30.73 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.262 -0.426 . . . . 62.53 110.939 179.885 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 227' ' ' SER . . . . . 0.465 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 1.4 t -86.93 154.84 20.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 74.21 110.932 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -62.82 -65.35 0.7 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.214 -0.448 . . . . 74.54 110.897 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -55.59 -26.09 41.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.225 -0.443 . . . . 74.2 110.863 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -69.64 -48.25 60.58 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.198 -0.456 . . . . 74.23 110.872 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 231' ' ' ILE . . . . . 0.406 HG12 ' HG3' ' A' ' 119' ' ' GLU . 8.6 mt -68.29 -42.82 84.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.171 -0.468 . . . . 73.41 111.211 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.21 -32.58 74.02 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.104 -0.498 . . . . 73.32 110.888 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -65.8 -48.3 68.01 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.748 -0.739 . . . . 65.45 112.495 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 11.8 tt -72.82 -30.61 33.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.79 0.328 . . . . 74.41 111.113 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -70.24 -24.03 63.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.147 -0.479 . . . . 71.13 110.907 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 236' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.49 -27.29 60.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.199 -0.455 . . . . 74.41 110.908 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 237' ' ' LEU . . . . . . . . . . . . . 9.8 tt -98.03 -32.55 11.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.167 -0.47 . . . . 75.41 110.911 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 238' ' ' TYR . . . . . . . . . . . . . 32.4 m-85 -91.87 -35.18 14.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.2 -0.455 . . . . 54.42 110.917 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -113.0 -120.47 3.7 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.746 -0.74 . . . . 72.22 112.494 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 1.2 tmtm? -100.66 131.59 46.49 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.811 0.339 . . . . 75.42 110.839 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.15 146.25 23.72 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.194 -0.457 . . . . 73.34 110.829 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -161.27 27.44 0.13 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.191 -0.458 . . . . 62.43 110.866 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 65.14 152.48 0.05 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.148 -0.478 . . . . 72.13 110.823 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -179.57 -169.78 0.15 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.164 -0.471 . . . . 71.41 110.908 -179.862 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.63 166.04 16.17 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.158 -0.474 . . . . 75.43 110.886 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -152.11 162.91 40.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.273 -0.421 . . . . 72.11 110.85 -180.0 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 116.177 -0.465 . . . . 74.13 110.838 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 302' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' -2' ' ' LEU . . . . . 0.596 ' N ' ' HD2' ' A' ' -1' ' ' PRO . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.098 0 CA-C-O 121.6 0.714 . . . . 73.02 110.899 . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' -1' ' ' PRO . . . . . 0.596 ' HD2' ' N ' ' A' ' -2' ' ' LEU . 53.7 Cg_endo -69.76 -172.98 0.63 Allowed 'Trans proline' 0 C--O 1.233 0.245 0 C-N-CA 122.729 2.286 . . . . 73.21 112.356 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 1.2 mp -122.24 160.64 46.9 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 121.594 0.712 . . . . 75.23 110.949 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.65 -11.97 32.11 Favored 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.687 2.258 . . . . 64.24 112.317 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -95.24 35.73 1.28 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.241 -0.436 . . . . 62.24 110.916 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -95.41 -27.99 15.16 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.247 -0.433 . . . . 74.01 110.836 -179.855 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -70.25 -34.18 72.52 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.135 -0.484 . . . . 71.4 111.114 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -55.99 -24.83 44.01 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.703 -0.76 . . . . 62.21 112.499 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -108.74 21.59 27.57 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.75 -0.738 . . . . 54.42 112.443 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 15.7 mtm -94.45 163.34 13.45 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.744 0.307 . . . . 72.23 110.922 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -115.52 168.83 9.66 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.308 -0.406 . . . . 73.24 110.871 -179.823 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -54.47 -31.8 56.44 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.157 -0.474 . . . . 73.44 110.9 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.48 -42.95 99.84 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.151 -0.477 . . . . 72.33 110.902 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.54 -41.22 98.47 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.163 -0.471 . . . . 72.14 110.896 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 5.4 t-105 -73.29 -33.6 65.31 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.159 -0.473 . . . . 71.22 110.933 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -73.31 -39.16 65.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.259 -0.428 . . . . 72.51 110.921 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 -74.05 -35.97 64.35 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.135 -0.484 . . . . 74.32 110.93 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -56.91 -44.16 82.13 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.225 -0.443 . . . . 74.22 111.123 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -73.53 -37.41 65.62 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.189 -0.46 . . . . 73.12 110.889 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -67.92 -30.98 70.44 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.174 -0.466 . . . . 72.4 110.93 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -69.95 -35.99 74.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.207 -0.451 . . . . 75.11 110.944 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.78 -20.93 64.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.17 -0.468 . . . . 75.43 110.923 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 5.7 ptmt -74.85 -31.48 61.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.168 -0.469 . . . . 75.45 110.903 179.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.2 ptp180 -86.37 -27.93 23.94 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.202 -0.454 . . . . 74.22 110.896 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.0 m-30 -77.82 -0.84 28.78 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.256 -0.429 . . . . 75.2 110.856 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -120.43 -75.34 0.59 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.112 -0.495 . . . . 74.4 110.946 -179.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 11.9 mt -160.93 155.37 23.31 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.147 -0.478 . . . . 75.43 110.934 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -82.61 89.16 6.68 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.264 -0.425 . . . . 71.41 110.9 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -125.19 131.34 53.21 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.104 -0.498 . . . . 74.25 110.911 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 84.7 p -85.15 -14.05 48.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.235 -0.439 . . . . 62.15 110.825 -179.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -70.03 -11.4 60.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.194 -0.457 . . . . 74.51 110.951 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.65 1.84 32.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.174 -0.466 . . . . 72.53 111.136 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 3.0 pttt -51.72 170.13 0.06 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.207 -0.451 . . . . 74.12 110.885 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 67.14 123.54 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.224 -0.444 . . . . 74.52 110.863 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.18 -24.1 66.07 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.177 -0.465 . . . . 71.02 111.168 179.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -65.45 -32.28 73.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.21 -0.45 . . . . 71.33 110.884 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 11.0 m -85.56 -20.12 30.07 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.18 -0.464 . . . . 74.02 110.862 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.613 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 3.6 mm? -62.34 -35.83 80.32 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.15 -0.477 . . . . 74.54 110.901 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.75 -50.37 72.46 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.165 -0.47 . . . . 73.13 110.88 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -52.64 -36.56 56.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.161 -0.472 . . . . 71.12 111.111 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.463 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.1 OUTLIER -70.7 -41.61 71.73 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.182 -0.463 . . . . 74.43 110.92 179.931 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.613 ' HG ' ' O ' ' A' ' 35' ' ' LEU . 25.4 mt -54.32 -38.05 65.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.215 -0.448 . . . . 74.44 110.951 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.0 mttt -58.72 -45.57 89.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.16 -0.473 . . . . 74.2 110.929 179.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.463 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 2.3 pt-20 -60.93 -32.68 72.17 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.219 -0.446 . . . . 75.11 110.912 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 4.5 ttt -66.83 -34.16 77.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.15 -0.477 . . . . 63.43 110.926 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.485 ' HG3' ' HA ' ' A' ' 51' ' ' THR . 2.5 mm-40 -58.67 -40.05 82.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.455 . . . . 75.32 110.89 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.7 mmpt? -72.79 -33.49 66.3 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.233 -0.44 . . . . 75.11 110.875 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 32.7 t80 -71.0 -37.18 72.67 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.26 -0.427 . . . . 73.32 110.848 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -81.78 -35.22 29.8 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.22 -0.446 . . . . 70.43 110.931 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 105.83 -10.34 44.76 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.748 -0.739 . . . . 64.42 112.509 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -66.0 135.79 95.35 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.619 0.723 . . . . 74.31 110.898 -179.906 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.76 -52.9 0.3 Allowed 'Trans proline' 0 C--N 1.342 0.228 0 C-N-CA 122.697 2.264 . . . . 74.5 112.325 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -52.67 108.22 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.205 -0.452 . . . . 72.24 111.13 179.949 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.485 ' HA ' ' HG3' ' A' ' 43' ' ' GLN . 21.1 p -107.88 168.09 9.52 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.165 -0.47 . . . . 73.25 111.126 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 60.16 16.92 43.49 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.688 -0.768 . . . . 64.24 112.494 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -128.12 134.02 49.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.772 0.32 . . . . 75.23 110.844 -179.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.409 ' HA ' ' HB ' ' A' ' 58' ' ' VAL . 24.6 tp -145.36 93.1 2.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.193 -0.458 . . . . 74.32 110.892 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.6 p30 174.38 -29.68 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.219 -0.446 . . . . 61.31 110.925 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 24.1 t -83.86 -97.68 0.06 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.151 -0.477 . . . . 75.25 110.833 -179.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 8.8 tpt180 -85.09 -33.05 22.5 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.14 -0.482 . . . . 74.13 110.949 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.409 ' HB ' ' HA ' ' A' ' 54' ' ' LEU . 44.7 t -59.06 -49.34 83.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.191 -0.459 . . . . 72.2 111.148 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -63.99 -30.9 51.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.162 -0.472 . . . . 75.2 111.082 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.01 -40.4 84.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.261 -0.427 . . . . 73.45 110.931 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -78.26 -30.1 15.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.133 -0.485 . . . . 74.52 111.144 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 7.9 mmm -68.18 -35.14 77.55 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.181 -0.463 . . . . 74.01 110.893 179.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -83.87 -24.33 30.91 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.182 -0.463 . . . . 45.15 110.918 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.25 148.48 50.11 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.54 0.686 . . . . 75.32 110.958 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.8 154.22 67.85 Favored 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.663 2.242 . . . . 72.11 112.344 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 40.9 ttp180 -153.38 -84.02 0.07 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.225 -0.443 . . . . 73.22 110.872 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -145.48 156.19 43.57 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.178 -0.465 . . . . 72.31 110.925 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.527 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -100.12 20.55 48.39 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.701 -0.762 . . . . 64.23 112.488 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.408 ' CG1' ' HD2' ' A' ' 70' ' ' PRO . 0.0 OUTLIER -111.29 141.88 25.28 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.725 0.774 . . . . 74.23 111.122 179.979 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . 0.408 ' HD2' ' CG1' ' A' ' 69' ' ' VAL . 54.4 Cg_endo -69.71 139.02 39.36 Favored 'Trans proline' 0 C--N 1.342 0.207 0 C-N-CA 122.736 2.291 . . . . 63.44 112.349 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 87.7 m-20 -61.55 -17.01 53.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.191 -0.459 . . . . 74.45 110.89 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -139.96 129.01 27.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.186 -0.461 . . . . 73.52 111.165 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -131.78 151.8 51.4 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.179 -0.464 . . . . 73.13 111.119 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 172.33 87.77 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.233 -0.44 . . . . 74.13 110.921 -179.948 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 28.0 p90 -175.13 170.16 3.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.131 -0.486 . . . . 71.51 110.944 -179.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.445 ' O ' ' OG ' ' A' ' 76' ' ' SER . 2.4 p 64.53 100.43 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.138 -0.483 . . . . 74.2 110.859 -179.828 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 73.84 -42.11 0.51 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.087 -0.506 . . . . 70.34 110.897 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . 0.444 ' H ' ' C ' ' A' ' 76' ' ' SER . 47.1 m-85 61.74 66.71 1.45 Allowed Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.592 0.71 . . . . 71.24 110.906 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.75 -174.86 0.98 Allowed 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.634 2.223 . . . . 73.34 112.359 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 50.6 m-80 -118.0 148.28 42.38 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.202 -0.454 . . . . 74.43 110.853 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.3 t 65.1 115.42 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.615 0.722 . . . . 70.4 110.838 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.86 -37.97 8.22 Favored 'Trans proline' 0 C--O 1.231 0.125 0 C-N-CA 122.714 2.276 . . . . 72.25 112.29 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.9 mttp -82.33 163.35 21.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.24 -0.436 . . . . 72.53 110.905 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . 0.493 ' CD1' ' HA ' ' A' ' 200' ' ' LEU . 47.0 m95 -62.95 135.2 57.17 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.226 -0.443 . . . . 73.31 110.955 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.35 1.37 13.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.303 -0.408 . . . . 71.34 111.154 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -77.81 163.71 25.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.152 -0.476 . . . . 73.12 110.908 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.72 -6.81 59.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.156 -0.475 . . . . 71.12 110.929 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -170.51 138.83 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.206 -0.452 . . . . 74.14 111.141 179.9 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 95.9 t -123.39 135.62 62.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.234 -0.439 . . . . 72.25 111.088 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 9.5 p -115.07 168.1 10.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.155 -0.475 . . . . 75.51 111.142 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.404 ' N ' ' CD1' ' A' ' 91' ' ' TYR . 2.9 p90 -144.58 147.42 33.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.18 -0.464 . . . . 70.51 110.947 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.4 ' HB2' ' HB2' ' A' ' 132' ' ' ALA . 5.4 tpt85 -148.03 134.72 19.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.138 -0.483 . . . . 74.3 110.871 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.2 mm -77.21 135.32 26.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.183 -0.462 . . . . 72.4 111.128 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.47 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 18.3 t -93.98 -40.5 11.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.22 -0.445 . . . . 74.41 111.138 179.857 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -151.63 169.56 21.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.081 -0.509 . . . . 64.24 110.848 -179.865 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 16.1 p90 -130.12 155.24 46.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.141 -0.481 . . . . 74.1 110.971 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.5 t -100.64 142.19 32.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 75.33 111.136 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -52.08 -18.46 1.44 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.215 -0.448 . . . . 72.14 110.859 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.97 -36.7 85.23 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.186 -0.461 . . . . 74.13 110.863 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.7 mp -144.07 152.81 55.72 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-O 121.623 0.725 . . . . 72.52 110.934 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . 0.406 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.7 Cg_endo -69.83 151.27 68.6 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.662 2.241 . . . . 73.11 112.319 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 2.7 t-160 -50.8 -28.3 9.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.18 -0.464 . . . . 74.11 110.88 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.406 HG22 ' HB2' ' A' ' 101' ' ' PRO . 2.7 tp -75.65 -38.32 37.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.205 -0.452 . . . . 74.02 111.068 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 3.1 m -69.21 -37.88 78.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.168 -0.469 . . . . 54.24 111.125 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 65.5 t -71.68 -44.48 69.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.214 -0.448 . . . . 73.13 111.15 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.613 ' O ' HG22 ' A' ' 109' ' ' VAL . 26.9 t0 -63.96 -38.55 91.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 63.44 110.85 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . 0.511 ' HG3' ' N ' ' A' ' 108' ' ' LEU . 0.0 OUTLIER -70.55 -33.44 71.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.189 -0.46 . . . . 75.02 110.875 -179.89 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.523 ' HB3' ' HD1' ' A' ' 188' ' ' PHE . 0.0 OUTLIER -66.21 -48.55 70.25 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.201 -0.454 . . . . 75.05 110.922 -179.993 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.613 HG22 ' O ' ' A' ' 106' ' ' ASP . 1.5 m -55.01 -43.17 68.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.189 -0.459 . . . . 72.31 111.06 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.487 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 45.3 t -70.65 -33.93 71.49 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.194 -0.457 . . . . 72.14 110.869 -179.789 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.1 -33.17 73.94 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.087 -0.506 . . . . 74.35 110.928 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.71 -40.27 9.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.244 -0.434 . . . . 74.32 111.135 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.413 HD13 HD12 ' A' ' 196' ' ' LEU . 0.4 OUTLIER -64.32 -33.04 74.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.135 -0.484 . . . . 74.11 110.915 179.981 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 45.0 t30 -69.82 -40.14 76.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.174 -0.466 . . . . 75.15 110.876 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -59.71 -34.33 72.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.163 -0.471 . . . . 74.0 110.921 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 13.3 m95 -65.8 -52.24 52.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.223 -0.444 . . . . 75.23 110.922 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . 0.445 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -63.52 -34.01 88.8 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.694 -0.765 . . . . 73.44 112.497 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.4 mtmt -63.67 -14.44 52.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.752 0.31 . . . . 74.42 110.892 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 61.2 mm-40 -104.04 13.27 32.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.233 -0.44 . . . . 75.55 110.894 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.445 ' CG1' ' HA2' ' A' ' 117' ' ' GLY . 6.7 pt -147.71 153.13 42.58 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.653 0.74 . . . . 71.34 111.149 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 1.99 3.91 Favored 'Trans proline' 0 C--N 1.342 0.226 0 C-N-CA 122.658 2.239 . . . . 75.35 112.362 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.42 ' HB3' ' H ' ' A' ' 123' ' ' HIS . 5.9 mt -61.46 -158.25 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.208 -0.451 . . . . 73.22 110.885 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.42 ' H ' ' HB3' ' A' ' 122' ' ' LEU . 5.0 t60 -160.15 145.05 14.82 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.116 -0.493 . . . . 74.12 110.843 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 42.4 m-85 -126.08 148.94 49.23 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.174 -0.466 . . . . 75.54 110.882 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.01 140.96 51.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.16 -0.473 . . . . 75.14 110.857 -179.921 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.01 141.19 34.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 74.04 110.869 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 22.2 m -102.92 133.79 45.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.214 -0.448 . . . . 50.13 111.177 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -147.06 -24.83 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.191 -0.459 . . . . 74.43 111.19 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -136.72 109.15 7.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.117 -0.492 . . . . 73.32 110.885 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.44 -159.74 14.39 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.756 -0.735 . . . . 62.11 112.482 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -101.8 155.54 18.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.786 0.326 . . . . 71.11 111.168 -179.88 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . 0.4 ' HB2' ' HB2' ' A' ' 92' ' ' ARG . . . -112.07 165.38 12.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.2 -0.455 . . . . 72.32 111.083 179.86 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -66.48 -62.8 1.27 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.191 -0.459 . . . . 75.41 110.853 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 37.6 mt -86.41 130.48 36.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.211 -0.45 . . . . 71.04 111.143 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' MET . . . . . 0.47 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 13.7 mmm -107.06 124.9 50.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.12 -0.491 . . . . 72.43 110.914 179.877 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -108.52 92.29 2.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.23 -0.441 . . . . 70.04 111.096 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . 0.401 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -130.31 170.15 20.99 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.738 -0.744 . . . . 63.34 112.497 179.865 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -108.61 149.62 28.65 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.875 0.369 . . . . 74.01 110.938 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . 175.83 166.91 0.39 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.456 . . . . 71.21 111.1 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 22.2 mtm180 -104.26 173.09 6.45 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.214 -0.448 . . . . 72.34 110.908 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -58.09 -15.73 23.04 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.722 -0.751 . . . . 74.24 112.466 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -99.05 13.36 33.09 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.769 0.319 . . . . 75.03 111.165 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 5.0 p80 -72.26 -8.86 57.13 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.172 -0.467 . . . . 73.45 110.843 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 117.95 50.38 0.35 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.773 -0.727 . . . . 60.43 112.55 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -172.7 171.86 4.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.808 0.337 . . . . 72.14 110.911 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 27.1 p -64.09 -179.79 0.46 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.18 -0.464 . . . . 64.54 110.849 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' TYR . . . . . 0.416 ' HA ' ' HD2' ' A' ' 148' ' ' PRO . 0.3 OUTLIER 64.48 103.92 0.03 OUTLIER Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.727 0.775 . . . . 73.4 110.949 -179.905 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . 0.416 ' HD2' ' HA ' ' A' ' 147' ' ' TYR . 54.2 Cg_endo -69.77 151.97 69.17 Favored 'Trans proline' 0 C--N 1.342 0.228 0 C-N-CA 122.612 2.208 . . . . 74.53 112.372 179.935 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 149' ' ' PHE . . . . . 0.404 ' O ' ' CG ' ' A' ' 150' ' ' ASP . 0.3 OUTLIER -53.38 -24.26 11.83 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.166 -0.47 . . . . 70.0 110.842 -179.942 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . 0.404 ' CG ' ' O ' ' A' ' 149' ' ' PHE . 1.9 p30 44.93 25.43 0.15 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.191 -0.459 . . . . 72.24 110.861 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 44.69 -165.05 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.719 -0.753 . . . . 75.42 112.48 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.72 144.36 53.98 Favored 'Trans proline' 0 C--N 1.343 0.24 0 C-N-CA 122.632 2.222 . . . . 75.11 112.36 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . 0.457 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 105.57 -131.76 10.8 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.775 -0.726 . . . . 70.32 112.445 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 154' ' ' ASN . . . . . 0.457 ' C ' ' O ' ' A' ' 153' ' ' GLY . 3.5 p30 -33.37 135.82 0.11 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.851 0.358 . . . . 74.45 110.891 -179.875 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 74.24 101.88 0.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.234 -0.439 . . . . 63.14 111.189 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . 0.487 HD11 HG13 ' A' ' 186' ' ' ILE . 0.4 OUTLIER -82.41 -56.89 3.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.16 -0.473 . . . . 75.02 110.94 179.98 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . 0.527 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -162.87 149.09 12.39 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.245 -0.434 . . . . 73.44 111.131 179.769 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 18.9 p-80 -105.19 126.09 51.71 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.267 -0.424 . . . . 74.34 110.809 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -110.53 153.06 25.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.181 -0.463 . . . . 74.42 111.105 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 15.1 m-85 -108.55 152.25 25.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.23 -0.441 . . . . 75.31 110.877 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -96.66 164.16 18.75 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.617 0.722 . . . . 71.14 111.112 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 85.33 0.62 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.672 2.248 . . . . 74.44 112.361 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -134.57 127.63 4.55 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.718 -0.753 . . . . 72.32 112.462 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 2.7 m 72.72 -69.78 0.18 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.847 0.356 . . . . 73.1 111.102 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . 166.61 -59.44 0.23 Allowed Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.767 -0.73 . . . . 74.03 112.454 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 8.7 tt -53.99 -37.7 64.29 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.741 0.305 . . . . 75.02 110.891 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -73.98 -166.19 13.21 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.68 -0.772 . . . . 43.43 112.519 179.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 73.01 18.04 78.93 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.642 -0.789 . . . . 74.31 112.483 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 74.9 m-20 -91.97 -172.4 3.15 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.796 0.331 . . . . 63.41 110.824 -179.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -124.47 131.36 53.49 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.19 -0.459 . . . . 74.21 111.116 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 10.9 m170 -129.0 137.91 51.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.216 -0.447 . . . . 72.53 110.809 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 47.1 m-85 -121.55 140.33 52.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.208 -0.451 . . . . 71.44 110.899 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 55.6 t0 -73.47 100.84 3.35 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.203 -0.453 . . . . 74.11 110.902 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.83 -16.42 11.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.115 -0.493 . . . . 74.45 110.86 -179.886 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -79.03 -16.37 56.94 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.125 -0.489 . . . . 73.32 110.875 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 31.4 mm-40 -83.48 -175.79 5.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.194 -0.457 . . . . 71.41 110.824 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -112.18 116.53 30.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.136 -0.484 . . . . 74.32 110.857 -179.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 49.6 m95 -116.82 139.41 50.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.176 -0.466 . . . . 74.32 110.947 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 9.0 t -177.46 163.6 1.99 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.221 -0.445 . . . . 74.13 111.231 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -125.12 -68.86 0.82 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.241 -0.436 . . . . 61.52 110.852 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -64.81 -12.15 52.59 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.706 -0.759 . . . . 62.41 112.523 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 182' ' ' SER . . . . . 0.425 ' O ' ' C ' ' A' ' 183' ' ' SER . 0.4 OUTLIER -94.52 -24.44 17.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.925 0.393 . . . . 74.0 110.876 -179.743 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 183' ' ' SER . . . . . 0.425 ' C ' ' O ' ' A' ' 182' ' ' SER . 3.2 p 35.32 58.03 0.82 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.103 -0.499 . . . . 64.12 110.894 -179.821 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -116.85 -33.53 4.75 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.101 -0.5 . . . . 74.43 110.915 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -119.79 -139.37 5.9 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.696 -0.764 . . . . 74.22 112.414 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 186' ' ' ILE . . . . . 0.487 HG13 HD11 ' A' ' 156' ' ' LEU . 6.9 mm -79.47 100.08 3.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.864 0.364 . . . . 73.22 111.118 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 28.6 m-20 -49.19 121.7 5.18 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.195 -0.457 . . . . 71.31 110.944 179.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 188' ' ' PHE . . . . . 0.523 ' HD1' ' HB3' ' A' ' 108' ' ' LEU . 1.5 t80 -54.03 -36.25 62.83 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.196 -0.456 . . . . 75.45 110.884 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . 0.414 HD22 HD13 ' A' ' 108' ' ' LEU . 0.2 OUTLIER -67.57 -47.62 69.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.139 -0.482 . . . . 60.14 110.867 -179.934 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 44.3 t80 -69.48 -38.94 77.92 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.256 -0.429 . . . . 74.22 110.901 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -72.13 -35.23 69.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.154 -0.475 . . . . 61.32 111.133 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 192' ' ' ALA . . . . . 0.481 ' O ' ' HB2' ' A' ' 196' ' ' LEU . . . -57.12 -45.02 83.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.161 -0.472 . . . . 52.32 111.031 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.97 -42.71 90.58 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.231 -0.44 . . . . 72.43 111.181 -179.886 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 15.0 t-160 -73.21 -38.56 66.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.228 -0.442 . . . . 71.44 110.909 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -75.38 -48.51 22.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 71.01 111.052 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 196' ' ' LEU . . . . . 0.481 ' HB2' ' O ' ' A' ' 192' ' ' ALA . 4.5 mm? -63.81 -40.02 95.63 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.236 -0.438 . . . . 74.52 110.943 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -58.91 -28.59 63.65 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.742 -0.742 . . . . 62.43 112.436 179.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 198' ' ' HIS . . . . . . . . . . . . . 7.1 m-70 -69.29 -32.42 71.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.738 0.304 . . . . 75.21 110.793 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -70.94 -21.26 62.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.207 -0.451 . . . . 73.13 110.874 -179.748 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 200' ' ' LEU . . . . . 0.493 ' HA ' ' CD1' ' A' ' 84' ' ' TRP . 0.3 OUTLIER -92.54 4.82 52.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.099 -0.501 . . . . 75.12 110.938 -179.984 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 83.37 -9.52 61.23 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.735 -0.745 . . . . 50.41 112.473 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 202' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.83 135.0 48.23 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.88 0.372 . . . . 71.04 110.854 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -109.79 159.22 14.08 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.768 -0.73 . . . . 64.44 112.409 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 12.4 m-70 -52.47 155.78 2.02 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.88 0.371 . . . . 74.32 110.837 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -117.27 153.01 33.67 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.182 -0.463 . . . . 72.42 110.855 -179.784 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 5.2 p -87.73 -4.9 58.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.157 -0.474 . . . . 72.22 110.859 -179.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -71.65 140.53 84.26 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.657 0.741 . . . . 65.11 110.886 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.82 -6.32 18.34 Favored 'Trans proline' 0 C--N 1.342 0.21 0 C-N-CA 122.693 2.262 . . . . 74.53 112.332 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 2.9 p30 -126.85 32.25 5.15 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.23 -0.441 . . . . 63.52 110.874 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 210' ' ' ALA . . . . . 0.478 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.11 146.07 26.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 64.4 111.103 179.845 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -73.63 -27.09 22.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 75.23 111.148 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 3.2 mmm -97.54 14.1 27.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.194 -0.457 . . . . 75.22 110.876 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 213' ' ' TYR . . . . . 0.413 ' CD2' ' OG1' ' A' ' 215' ' ' THR . 0.1 OUTLIER -55.23 121.98 40.23 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-O 121.612 0.72 . . . . 73.43 110.992 -179.95 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.73 -18.79 36.94 Favored 'Trans proline' 0 N--CA 1.465 -0.203 0 C-N-CA 122.716 2.278 . . . . 63.01 112.364 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 215' ' ' THR . . . . . 0.413 ' OG1' ' CD2' ' A' ' 213' ' ' TYR . 5.9 p -84.37 53.28 2.59 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.247 -0.433 . . . . 74.24 111.14 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 8.0 t80 -70.73 122.72 20.36 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.224 -0.444 . . . . 74.42 110.955 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -111.81 171.28 14.12 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.718 -0.754 . . . . 74.22 112.387 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -58.25 -56.23 24.71 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.89 0.376 . . . . 64.22 110.902 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . -51.71 102.9 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.785 -0.722 . . . . 73.55 112.474 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 220' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -95.52 153.6 39.46 Favored Pre-proline 0 C--N 1.327 -0.389 0 CA-C-O 121.559 0.695 . . . . 73.41 110.855 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -69.86 168.99 20.11 Favored 'Trans proline' 0 C--O 1.231 0.15 0 C-N-CA 122.662 2.241 . . . . 74.21 112.279 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 4.7 mm100 -70.02 -45.43 67.23 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.212 -0.449 . . . . 75.43 110.913 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -130.24 -40.45 1.29 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.196 -0.456 . . . . 70.33 110.883 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 224' ' ' PHE . . . . . 0.434 ' CD1' ' C ' ' A' ' 224' ' ' PHE . 0.0 OUTLIER 65.58 136.66 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.186 -0.461 . . . . 71.11 110.848 179.987 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -143.99 -178.19 5.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.185 -0.461 . . . . 65.02 110.875 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.71 148.02 35.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 62.53 110.909 179.925 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 227' ' ' SER . . . . . 0.478 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 1.4 t -90.71 151.62 21.16 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.198 -0.455 . . . . 74.21 110.826 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 42.6 tt0 -67.46 -60.7 2.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.088 -0.505 . . . . 74.54 110.958 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -58.36 -26.08 62.75 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.214 -0.448 . . . . 74.2 110.865 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -69.78 -48.82 57.82 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.19 -0.459 . . . . 74.23 110.904 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 231' ' ' ILE . . . . . . . . . . . . . 10.5 mt -68.63 -44.83 82.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 73.41 111.153 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.2 -32.77 66.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.176 -0.466 . . . . 73.32 110.902 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -64.26 -49.79 63.99 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.703 -0.76 . . . . 65.45 112.456 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 12.8 tt -73.15 -31.82 36.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.72 0.295 . . . . 74.41 111.115 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -62.65 -24.3 67.54 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.142 -0.481 . . . . 71.13 110.895 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 236' ' ' LYS . . . . . 0.434 ' HE3' ' HB2' ' A' ' 237' ' ' LEU . 0.1 OUTLIER -74.66 -22.11 59.06 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.2 -0.455 . . . . 74.41 110.868 179.994 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 237' ' ' LEU . . . . . 0.434 ' HB2' ' HE3' ' A' ' 236' ' ' LYS . 10.6 tt -97.34 -33.73 11.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.206 -0.452 . . . . 75.41 110.926 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 238' ' ' TYR . . . . . . . . . . . . . 47.4 m-85 -92.04 -35.31 14.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.174 -0.466 . . . . 54.42 110.902 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -129.38 -120.01 2.21 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.709 -0.757 . . . . 72.22 112.508 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 15.9 tttm -129.27 120.3 25.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.777 0.322 . . . . 75.42 110.922 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 1.2 tpt85 -175.03 -172.03 0.57 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.264 -0.426 . . . . 73.34 110.862 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -134.5 -174.39 3.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.171 -0.468 . . . . 62.43 110.805 -179.715 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 60.39 95.8 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.129 -0.487 . . . . 72.13 110.879 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 44.3 t -120.72 104.73 10.13 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.168 -0.469 . . . . 71.41 110.875 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 1.5 ttm180 -111.99 58.34 0.63 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.135 -0.484 . . . . 75.43 110.876 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -103.76 134.01 47.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.21 -0.45 . . . . 72.11 110.915 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 15.2 mmtt . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.237 -0.438 . . . . 74.13 110.93 179.857 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 302' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' -2' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.153 0 CA-C-O 121.511 0.672 . . . . 73.02 111.011 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' -1' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.69 -170.96 0.42 Allowed 'Trans proline' 0 C--O 1.231 0.131 0 C-N-CA 122.728 2.285 . . . . 73.21 112.303 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 0' ' ' LEU . . . . . 0.46 ' CD1' ' N ' ' A' ' 0' ' ' LEU . 0.0 OUTLIER -150.14 63.04 5.93 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.627 0.727 . . . . 75.23 110.908 179.881 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.72 -174.26 0.87 Allowed 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.722 2.281 . . . . 64.24 112.311 179.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -133.56 74.71 1.57 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.163 -0.471 . . . . 62.24 110.877 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -95.08 -24.66 16.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.213 -0.449 . . . . 74.01 110.848 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.47 -33.94 66.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.161 -0.472 . . . . 71.4 111.146 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -55.85 -27.27 49.85 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.73 -0.748 . . . . 62.21 112.552 -180.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -108.73 19.64 30.53 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.725 -0.75 . . . . 54.42 112.491 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.82 154.86 31.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.828 0.347 . . . . 72.23 110.87 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -115.6 168.76 9.73 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.2 -0.454 . . . . 73.24 110.865 -179.852 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -54.55 -33.14 59.61 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.15 -0.477 . . . . 73.44 110.911 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.49 -42.78 78.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.153 -0.476 . . . . 72.33 110.876 -179.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -65.88 -41.13 91.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.228 -0.442 . . . . 72.14 110.879 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 16.0 t-105 -72.83 -44.31 61.58 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.192 -0.458 . . . . 71.22 110.86 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 78.4 tt0 -62.31 -35.25 78.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.222 -0.445 . . . . 72.51 110.814 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 64.0 mm-40 -74.24 -36.61 63.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.171 -0.468 . . . . 74.32 110.914 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.89 -43.78 78.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.202 -0.453 . . . . 74.22 111.125 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.401 ' HG3' ' N ' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -73.07 -32.18 64.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.182 -0.463 . . . . 73.12 110.933 -179.938 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.401 ' N ' ' HG3' ' A' ' 16' ' ' GLN . 83.4 m-20 -77.66 -30.91 52.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.174 -0.466 . . . . 72.4 110.898 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.97 -35.69 75.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.153 -0.476 . . . . 75.11 110.938 -179.848 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -71.26 -21.41 62.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.118 -0.492 . . . . 75.43 110.92 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 4.1 ptmt -75.32 -28.6 59.72 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.188 -0.46 . . . . 75.45 110.919 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.8 ptp180 -86.36 -27.11 24.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.213 -0.448 . . . . 74.22 110.912 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -59.67 -25.32 64.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.181 -0.463 . . . . 75.2 110.877 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.433 ' O ' ' HB3' ' A' ' 70' ' ' PRO . 14.5 m-85 -92.26 -74.05 0.53 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.125 -0.489 . . . . 74.4 110.924 -179.876 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 83.4 mt -154.43 18.31 0.47 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.077 -0.511 . . . . 75.43 110.865 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 4.1 t80 47.99 89.76 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.191 -0.459 . . . . 71.41 110.891 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -125.06 128.44 48.5 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.123 -0.489 . . . . 74.25 110.845 179.913 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.3 p -74.14 -6.41 47.51 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.197 -0.456 . . . . 62.15 110.871 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.92 -13.11 55.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.115 -0.493 . . . . 74.51 110.888 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 4.5 m -85.18 8.32 18.71 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.165 -0.471 . . . . 72.53 111.15 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -51.09 169.49 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.198 -0.455 . . . . 74.12 110.844 179.944 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 33.1 t30 65.05 154.38 0.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.178 -0.464 . . . . 74.52 110.861 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.99 -20.21 59.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.177 -0.465 . . . . 71.02 111.134 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -56.77 -25.39 55.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.169 -0.469 . . . . 71.33 110.91 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 4.1 m -85.7 -22.12 27.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.182 -0.463 . . . . 74.02 110.905 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.53 -44.85 95.34 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.124 -0.489 . . . . 74.54 110.916 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.4 -51.38 63.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.222 -0.444 . . . . 73.13 110.849 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.28 -51.17 68.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.159 -0.473 . . . . 71.12 111.06 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 5.1 mmtt -59.74 -49.48 77.56 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.209 -0.45 . . . . 74.43 110.917 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -55.19 -38.74 68.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 74.44 110.964 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.38 -46.49 88.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 74.2 111.005 179.751 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -70.39 -37.06 74.45 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.173 -0.467 . . . . 75.11 110.925 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 3.2 ttt -68.73 -46.0 70.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.197 -0.456 . . . . 63.43 110.893 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 18.5 mt-30 -57.31 -43.5 83.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.235 -0.439 . . . . 75.32 110.921 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.6 mmpt? -69.14 -26.73 65.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.213 -0.449 . . . . 75.11 110.86 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -69.99 -36.25 75.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.26 -0.427 . . . . 73.32 110.926 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -80.48 -30.65 37.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.115 -0.493 . . . . 70.43 110.85 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 105.55 -10.55 46.04 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.749 -0.739 . . . . 64.42 112.465 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.411 HD12 HG13 ' A' ' 50' ' ' ILE . 0.6 OUTLIER -63.13 140.06 97.62 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.576 0.703 . . . . 74.31 110.938 -179.881 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.75 -51.9 0.36 Allowed 'Trans proline' 0 C--O 1.231 0.169 0 C-N-CA 122.669 2.246 . . . . 74.5 112.325 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.411 HG13 HD12 ' A' ' 48' ' ' LEU . 0.7 OUTLIER -48.82 108.21 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.238 -0.437 . . . . 72.24 111.146 179.936 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 1.8 t -111.28 159.33 18.04 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.167 -0.47 . . . . 73.25 111.054 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 58.37 17.07 30.71 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.799 -0.715 . . . . 64.24 112.49 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.2 mtp -127.49 161.05 29.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.823 0.344 . . . . 75.23 110.828 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 20.4 tp -154.38 96.81 1.96 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.223 -0.444 . . . . 74.32 110.944 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 177.51 -32.13 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.2 -0.454 . . . . 61.31 110.933 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 5.0 m -79.51 -100.71 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.162 -0.472 . . . . 75.25 110.795 -179.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.0 mmt85 -84.82 -29.4 25.39 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.166 -0.47 . . . . 74.13 110.864 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 16.3 t -58.84 -44.06 89.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.234 -0.439 . . . . 72.2 111.124 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 3.4 mm -75.51 -31.31 23.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.19 -0.459 . . . . 75.2 111.116 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.94 -44.55 92.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.148 -0.478 . . . . 73.45 110.874 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 30.3 pt -64.9 -29.89 48.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.196 -0.456 . . . . 74.52 111.117 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 8.1 mmt -65.16 -36.88 85.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.227 -0.442 . . . . 74.01 110.909 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -90.59 -24.59 20.51 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.177 -0.465 . . . . 45.15 110.948 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 2.8 tppt? -84.88 130.76 51.35 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.552 0.692 . . . . 75.32 110.961 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 126.08 12.89 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.657 2.238 . . . . 72.11 112.36 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 19.7 ttp180 -122.18 -84.67 0.66 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.191 -0.459 . . . . 73.22 110.883 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -145.96 147.46 31.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.18 -0.464 . . . . 72.31 110.891 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.59 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -98.41 20.85 48.8 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.74 -0.743 . . . . 64.23 112.518 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -109.62 130.83 22.35 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.609 0.719 . . . . 74.23 111.165 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . 0.433 ' HB3' ' O ' ' A' ' 23' ' ' TYR . 54.3 Cg_endo -69.79 159.39 53.56 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.647 2.231 . . . . 63.44 112.367 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -113.52 28.62 8.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.237 -0.438 . . . . 74.45 110.872 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 3.2 m -127.32 129.21 70.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.165 -0.471 . . . . 73.52 111.163 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -131.05 170.45 14.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.156 -0.475 . . . . 73.13 111.139 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -146.59 113.84 6.25 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.244 -0.435 . . . . 74.13 110.967 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 29.6 t80 -51.61 126.4 17.46 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.136 -0.484 . . . . 71.51 110.892 -179.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 179.76 100.55 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.097 -0.501 . . . . 74.2 110.833 -179.857 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.9 mp 54.45 23.02 4.19 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.063 -0.517 . . . . 70.34 110.912 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -50.89 160.59 0.78 Allowed Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 121.672 0.749 . . . . 71.24 110.913 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.414 ' HG3' ' HA2' ' A' ' 163' ' ' GLY . 54.0 Cg_endo -69.68 -174.85 0.97 Allowed 'Trans proline' 0 C--N 1.341 0.156 0 C-N-CA 122.74 2.293 . . . . 73.34 112.311 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -78.59 118.35 20.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.239 -0.437 . . . . 74.43 110.851 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 6.1 m 64.73 148.22 0.11 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.741 0.781 . . . . 70.4 110.799 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 -50.64 0.44 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.723 2.282 . . . . 72.25 112.313 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 2.7 mtpt -96.77 164.72 12.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.167 -0.47 . . . . 72.53 110.932 179.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 40.8 m0 -46.42 110.5 0.28 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.227 -0.442 . . . . 73.31 110.914 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 15.2 t -115.1 1.26 13.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.248 -0.433 . . . . 71.34 111.169 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.4 172.68 3.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.221 -0.445 . . . . 73.12 110.849 -179.837 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.4 -30.43 37.77 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.162 -0.472 . . . . 71.12 110.899 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -159.66 144.83 6.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.449 . . . . 74.14 111.163 179.92 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 12.9 t -127.68 131.92 69.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.252 -0.431 . . . . 72.25 111.15 179.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 22.9 p -115.44 150.51 36.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.222 -0.444 . . . . 75.51 111.165 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 5.7 p90 -130.85 146.41 52.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.191 -0.459 . . . . 70.51 110.931 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 12.6 ttt180 -149.14 137.0 20.54 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.091 -0.504 . . . . 74.3 110.887 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 11.7 mm -75.02 135.25 27.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.153 -0.476 . . . . 72.4 111.157 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.431 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 18.4 t -90.19 -40.51 12.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.189 -0.46 . . . . 74.41 111.105 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 36.2 t -153.94 169.48 23.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.225 -0.443 . . . . 64.24 110.88 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 14.7 p90 -133.07 155.11 49.82 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.111 -0.495 . . . . 74.1 110.954 -179.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.9 t -99.43 141.91 31.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.165 -0.471 . . . . 75.33 111.16 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 7.7 ptp85 -52.01 -19.98 2.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.215 -0.448 . . . . 72.14 110.826 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.9 -34.77 71.88 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.261 -0.427 . . . . 74.13 110.808 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 6.5 mt -136.08 141.14 35.28 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.628 0.728 . . . . 72.52 110.888 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . 0.432 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.8 Cg_endo -69.78 151.0 68.84 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.717 2.278 . . . . 73.11 112.316 179.879 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 2.3 t-160 -53.52 -25.38 16.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.222 -0.445 . . . . 74.11 110.864 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.432 HG22 ' HB2' ' A' ' 101' ' ' PRO . 15.1 tt -77.43 -41.16 29.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.217 -0.447 . . . . 74.02 111.12 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 6.6 m -69.32 -39.05 78.44 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.224 -0.444 . . . . 54.24 111.206 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 71.7 t -71.21 -45.5 70.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.157 -0.474 . . . . 73.13 111.112 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.582 ' O ' HG22 ' A' ' 109' ' ' VAL . 53.6 t0 -63.32 -39.86 95.74 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.196 -0.457 . . . . 63.44 110.854 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . 0.509 ' HG3' ' N ' ' A' ' 108' ' ' LEU . 0.1 OUTLIER -70.15 -33.57 71.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.232 -0.44 . . . . 75.02 110.891 -179.865 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.523 ' HB3' ' HD1' ' A' ' 188' ' ' PHE . 0.0 OUTLIER -65.17 -48.47 73.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.133 -0.485 . . . . 75.05 110.887 -179.957 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.582 HG22 ' O ' ' A' ' 106' ' ' ASP . 1.2 m -55.15 -42.49 65.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.226 -0.443 . . . . 72.31 111.144 179.842 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.484 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 30.9 t -70.15 -34.71 73.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.13 -0.487 . . . . 72.14 110.869 -179.854 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.74 -33.43 75.11 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.124 -0.489 . . . . 74.35 110.895 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -93.51 -42.08 9.43 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.228 -0.442 . . . . 74.32 111.113 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.1 -34.14 77.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.243 -0.435 . . . . 74.11 110.958 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . 0.4 ' CB ' ' O ' ' A' ' 110' ' ' SER . 22.2 t30 -68.6 -35.42 77.32 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.148 -0.478 . . . . 75.15 110.862 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.19 -34.14 77.67 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.236 -0.438 . . . . 74.0 110.882 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 14.6 m95 -67.01 -45.37 77.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.193 -0.458 . . . . 75.23 110.876 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . 0.415 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -67.96 -36.5 86.41 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.73 -0.747 . . . . 73.44 112.49 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.26 -17.41 53.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.767 0.317 . . . . 74.42 110.948 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -99.99 13.46 33.89 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.247 -0.433 . . . . 75.55 110.898 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.531 ' C ' ' H ' ' A' ' 122' ' ' LEU . 7.7 pt -149.28 143.69 17.18 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.521 0.677 . . . . 71.34 111.166 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 26.0 0.18 Allowed 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.625 2.216 . . . . 75.35 112.355 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.531 ' H ' ' C ' ' A' ' 120' ' ' ILE . 12.5 mt -78.99 -161.19 0.28 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 73.22 110.903 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.403 ' H ' ' HB3' ' A' ' 122' ' ' LEU . 3.3 t60 -150.63 121.06 7.37 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.148 -0.478 . . . . 74.12 110.865 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 9.2 m-30 -110.61 147.47 34.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.22 -0.445 . . . . 75.54 110.925 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.14 142.07 50.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.455 . . . . 75.14 110.923 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.37 160.09 25.51 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.234 -0.439 . . . . 74.04 110.929 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 17.8 m -103.29 126.57 57.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.258 -0.428 . . . . 50.13 111.062 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -146.9 -11.19 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.138 -0.483 . . . . 74.43 111.066 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -156.78 109.05 2.49 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.203 -0.453 . . . . 73.32 110.95 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 103.04 -164.93 15.89 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.79 -0.719 . . . . 62.11 112.541 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.97 155.44 18.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.798 0.332 . . . . 71.11 111.122 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -112.46 165.55 12.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.242 -0.436 . . . . 72.32 111.093 179.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -76.03 -40.99 52.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.206 -0.452 . . . . 75.41 110.857 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 3.1 mm -93.93 107.65 19.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.168 -0.469 . . . . 71.04 111.164 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' MET . . . . . 0.431 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 8.1 mmm -99.58 121.55 41.36 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.207 -0.451 . . . . 72.43 110.897 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -106.96 97.15 5.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.252 -0.431 . . . . 70.04 111.125 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -129.85 168.1 21.38 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.728 -0.749 . . . . 63.34 112.466 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' PHE . . . . . 0.411 ' O ' ' CB ' ' A' ' 139' ' ' ALA . 44.4 m-85 -105.25 143.46 33.39 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.808 0.337 . . . . 74.01 110.911 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.411 ' CB ' ' O ' ' A' ' 138' ' ' PHE . . . 168.28 166.27 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.132 -0.486 . . . . 71.21 111.044 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 1.5 ptp180 -107.5 174.33 5.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.22 -0.445 . . . . 72.34 110.846 -179.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . 0.487 ' H ' ' HA ' ' A' ' 149' ' ' PHE . . . -54.4 -17.55 8.49 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.785 -0.721 . . . . 74.24 112.463 -179.911 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -89.17 13.26 13.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.899 0.381 . . . . 75.03 111.115 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 6.4 p80 -79.71 0.19 31.53 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.217 -0.447 . . . . 73.45 110.858 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 105.49 51.6 0.85 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.725 -0.75 . . . . 60.43 112.447 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -165.76 175.56 8.67 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.788 0.328 . . . . 72.14 110.898 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.93 177.11 0.82 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 64.54 110.9 -179.823 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 64.69 119.31 0.02 OUTLIER Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.71 0.767 . . . . 73.4 110.936 -179.861 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.72 151.3 69.27 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 122.676 2.251 . . . . 74.53 112.38 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 149' ' ' PHE . . . . . 0.519 ' O ' ' CG ' ' A' ' 150' ' ' ASP . 2.0 p90 -53.72 -32.89 53.73 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.246 -0.434 . . . . 70.0 110.894 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . 0.519 ' CG ' ' O ' ' A' ' 149' ' ' PHE . 2.8 p30 49.99 15.87 0.2 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.123 -0.49 . . . . 72.24 110.815 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . 0.421 ' C ' ' O ' ' A' ' 150' ' ' ASP . . . 36.72 -153.16 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.723 -0.751 . . . . 75.42 112.457 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 143.58 51.42 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.624 2.216 . . . . 75.11 112.354 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . 0.445 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 105.11 -132.53 11.14 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.753 -0.737 . . . . 70.32 112.559 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 154' ' ' ASN . . . . . 0.445 ' C ' ' O ' ' A' ' 153' ' ' GLY . 2.1 p30 -34.67 143.39 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.96 0.409 . . . . 74.45 110.8 -179.889 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 67.69 109.58 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.114 -0.494 . . . . 63.14 111.148 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . 0.482 HD12 HG13 ' A' ' 186' ' ' ILE . 0.8 OUTLIER -88.56 -55.41 3.73 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.253 -0.43 . . . . 75.02 110.928 179.962 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . 0.59 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -159.87 148.75 17.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.152 -0.476 . . . . 73.44 111.038 179.81 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 27.3 p-80 -108.25 125.68 51.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.136 -0.484 . . . . 74.34 110.89 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -110.34 166.53 10.91 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.215 -0.448 . . . . 74.42 111.106 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 21.2 m-30 -115.7 147.32 41.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.257 -0.429 . . . . 75.31 110.887 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -79.99 164.28 53.62 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.608 0.718 . . . . 71.14 111.056 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.81 71.44 1.54 Allowed 'Trans proline' 0 N--CA 1.465 -0.154 0 C-N-CA 122.742 2.295 . . . . 74.44 112.306 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 163' ' ' GLY . . . . . 0.414 ' HA2' ' HG3' ' A' ' 79' ' ' PRO . . . -127.44 100.31 0.54 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.763 -0.732 . . . . 72.32 112.518 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 66.9 172.35 0.25 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.85 0.357 . . . . 73.1 111.095 -179.85 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -54.35 -37.13 59.13 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.753 -0.737 . . . . 74.03 112.466 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 4.0 tt -71.26 -19.64 62.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.792 0.33 . . . . 75.02 110.945 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -93.57 144.64 17.21 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.757 -0.735 . . . . 43.43 112.496 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 102.75 13.04 30.85 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.778 -0.725 . . . . 74.31 112.5 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 29.4 m-20 -82.62 167.62 18.11 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.856 0.36 . . . . 63.41 110.86 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -125.75 130.68 51.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.208 -0.451 . . . . 74.21 111.114 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 23.1 m170 -130.66 132.05 45.21 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.286 -0.415 . . . . 72.53 110.887 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -115.8 139.41 50.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 71.44 110.859 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 48.3 t0 -71.31 99.77 2.01 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.121 -0.49 . . . . 74.11 110.854 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 1.6 pp20? -57.21 -16.99 9.42 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.231 -0.441 . . . . 74.45 110.913 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -76.36 -16.21 59.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.17 -0.468 . . . . 73.32 110.887 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 23.6 mm-40 -84.34 -174.62 5.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.2 -0.455 . . . . 71.41 110.903 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 12.2 mtt85 -116.49 116.26 27.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.189 -0.46 . . . . 74.32 110.828 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 13.0 m95 -116.95 146.29 43.08 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.135 -0.484 . . . . 74.32 110.854 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 7.4 t -178.93 163.8 1.41 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.25 -0.432 . . . . 74.13 111.14 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -123.49 -68.11 0.89 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.45 . . . . 61.52 110.901 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -66.63 -10.83 55.68 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.829 -0.701 . . . . 62.41 112.475 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 182' ' ' SER . . . . . 0.455 ' O ' ' C ' ' A' ' 183' ' ' SER . 0.3 OUTLIER -97.32 -24.43 15.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.911 0.386 . . . . 74.0 110.842 -179.716 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 183' ' ' SER . . . . . 0.455 ' C ' ' O ' ' A' ' 182' ' ' SER . 2.9 p 33.33 60.99 0.45 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.107 -0.497 . . . . 64.12 110.926 -179.754 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 16.5 tp -116.85 -33.57 4.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.114 -0.494 . . . . 74.43 110.921 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -121.58 -137.4 5.22 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.747 -0.739 . . . . 74.22 112.514 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 186' ' ' ILE . . . . . 0.482 HG13 HD12 ' A' ' 156' ' ' LEU . 6.6 mm -79.47 99.92 3.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.827 0.346 . . . . 73.22 111.165 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 27.1 m120 -50.93 121.98 6.8 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.2 -0.454 . . . . 71.31 110.85 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 188' ' ' PHE . . . . . 0.523 ' HD1' ' HB3' ' A' ' 108' ' ' LEU . 1.6 t80 -53.93 -35.7 61.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.136 -0.484 . . . . 75.45 110.886 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.21 -47.6 70.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.181 -0.463 . . . . 60.14 110.881 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 6.2 t80 -69.52 -37.26 77.07 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.165 -0.47 . . . . 74.22 110.944 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -72.65 -35.78 67.84 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.098 -0.501 . . . . 61.32 111.071 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 192' ' ' ALA . . . . . 0.447 ' O ' ' HB2' ' A' ' 196' ' ' LEU . . . -61.48 -44.59 96.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.247 -0.433 . . . . 52.32 111.107 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 17.7 m -58.52 -45.22 89.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.172 -0.467 . . . . 72.43 111.136 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 20.8 t-160 -72.59 -40.11 66.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.181 -0.463 . . . . 71.44 110.838 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -71.02 -47.0 61.16 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.232 -0.44 . . . . 71.01 111.165 179.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 196' ' ' LEU . . . . . 0.513 ' N ' HD21 ' A' ' 196' ' ' LEU . 4.5 mm? -64.88 -38.88 92.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.225 -0.443 . . . . 74.52 110.898 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -62.48 -26.69 68.46 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.673 -0.775 . . . . 62.43 112.483 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 198' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -65.24 -41.47 94.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.864 0.364 . . . . 75.21 110.93 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 31.9 t -64.57 -22.4 66.96 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.134 -0.485 . . . . 73.13 110.893 -179.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 2.4 mt -83.11 -2.55 55.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.059 -0.519 . . . . 75.12 110.865 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 84.09 4.7 88.19 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.715 -0.755 . . . . 50.41 112.501 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 202' ' ' MET . . . . . 0.414 ' CE ' ' HB ' ' A' ' 234' ' ' ILE . 43.8 tpp -65.82 144.61 56.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.836 0.35 . . . . 71.04 110.874 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -106.19 159.09 15.24 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.761 -0.733 . . . . 64.44 112.546 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 27.2 m-70 -58.1 166.12 1.68 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.796 0.332 . . . . 74.32 110.913 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 2.1 t -128.56 149.18 50.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.24 -0.436 . . . . 72.42 110.825 -179.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 1.1 m -88.07 -4.28 58.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.081 -0.509 . . . . 72.22 110.843 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 207' ' ' ASP . . . . . 0.429 ' O ' ' CD1' ' A' ' 213' ' ' TYR . 0.1 OUTLIER -71.27 135.51 84.51 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.59 0.709 . . . . 65.11 110.845 -179.962 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.7 -7.7 21.72 Favored 'Trans proline' 0 C--O 1.231 0.148 0 C-N-CA 122.691 2.26 . . . . 74.53 112.352 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 -127.53 24.27 6.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.258 -0.428 . . . . 63.52 110.89 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 210' ' ' ALA . . . . . 0.429 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.55 145.76 26.08 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.112 -0.495 . . . . 64.4 111.113 179.831 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -68.44 -24.94 30.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.144 -0.48 . . . . 75.23 111.146 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 1.5 mpp? -95.09 9.7 38.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.464 . . . . 75.22 110.885 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 213' ' ' TYR . . . . . 0.429 ' CD1' ' O ' ' A' ' 207' ' ' ASP . 1.8 t80 -55.06 116.75 12.15 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.689 0.757 . . . . 73.43 110.961 -179.884 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.81 -17.98 37.02 Favored 'Trans proline' 0 C--O 1.232 0.208 0 C-N-CA 122.639 2.226 . . . . 63.01 112.353 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -83.93 2.85 36.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.251 -0.431 . . . . 74.24 111.132 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 1.2 t80 64.1 122.78 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.239 -0.437 . . . . 74.42 110.901 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -54.44 117.14 7.31 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.751 -0.738 . . . . 74.22 112.512 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 8.5 m-20 -63.2 161.73 13.14 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.869 0.366 . . . . 64.22 110.893 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . 73.38 167.44 12.96 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.756 -0.735 . . . . 73.55 112.475 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 220' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -107.52 101.47 39.62 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 121.559 0.695 . . . . 73.41 110.822 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.75 131.87 22.16 Favored 'Trans proline' 0 C--O 1.231 0.149 0 C-N-CA 122.664 2.243 . . . . 74.21 112.371 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -70.46 -39.64 74.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.256 -0.429 . . . . 75.43 110.943 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -126.91 -39.85 1.92 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.158 -0.474 . . . . 70.33 110.894 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 64.57 139.26 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.147 -0.479 . . . . 71.11 110.899 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.87 169.32 18.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.096 -0.502 . . . . 65.02 110.914 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.83 150.73 27.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.205 -0.452 . . . . 62.53 110.898 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 227' ' ' SER . . . . . 0.429 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 9.8 t -85.4 159.12 20.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.173 -0.467 . . . . 74.21 110.866 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -64.24 -67.24 0.45 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.163 -0.472 . . . . 74.54 110.926 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -55.12 -25.68 33.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.164 -0.471 . . . . 74.2 110.935 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -69.09 -48.47 62.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.184 -0.462 . . . . 74.23 110.814 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 231' ' ' ILE . . . . . . . . . . . . . 10.2 mt -68.22 -42.94 85.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.216 -0.447 . . . . 73.41 111.137 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 35.4 pttt -65.14 -32.25 73.85 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.164 -0.471 . . . . 73.32 110.872 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -62.8 -48.89 77.51 Favored Glycine 0 C--N 1.33 0.225 0 C-N-CA 120.704 -0.76 . . . . 65.45 112.449 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 234' ' ' ILE . . . . . 0.414 ' HB ' ' CE ' ' A' ' 202' ' ' MET . 11.4 tt -73.05 -31.95 37.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.782 0.325 . . . . 74.41 111.095 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -67.69 -32.71 73.55 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.225 -0.443 . . . . 71.13 110.873 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 236' ' ' LYS . . . . . 0.445 ' HE3' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.17 -22.01 59.6 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.187 -0.46 . . . . 74.41 110.907 179.964 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 237' ' ' LEU . . . . . 0.445 ' HB2' ' HE3' ' A' ' 236' ' ' LYS . 5.7 tt -97.62 -28.2 14.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.264 -0.425 . . . . 75.41 110.957 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 238' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -92.12 -35.67 13.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.145 -0.48 . . . . 54.42 110.964 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -118.26 -121.78 3.12 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.72 -0.752 . . . . 72.22 112.508 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 5.2 tttm -87.17 120.37 28.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.773 0.321 . . . . 75.42 110.874 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 20.2 mtm180 -51.64 168.85 0.07 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.235 -0.439 . . . . 73.34 110.879 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 10.7 t -137.37 -41.55 0.56 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.231 -0.44 . . . . 62.43 110.863 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 2.3 m120 63.5 81.56 0.2 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.126 -0.488 . . . . 72.13 110.876 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 97.7 p -174.79 33.47 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.219 -0.446 . . . . 71.41 110.896 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 3.0 ttp180 -110.26 179.32 4.13 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.092 -0.504 . . . . 75.43 110.851 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 4.9 ttpt -161.88 48.29 0.19 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.191 -0.459 . . . . 72.11 110.889 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.45 . . . . 74.13 110.905 179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 302' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' -2' ' ' LEU . . . . . . . . . . . . . 2.8 mp . . . . . 0 C--O 1.231 0.123 0 CA-C-O 121.533 0.682 . . . . 73.02 110.939 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' -1' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.74 -48.25 0.76 Allowed 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.644 2.229 . . . . 73.21 112.376 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 2.8 mt 64.28 154.6 0.12 Allowed Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.618 0.723 . . . . 75.23 110.914 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 -170.98 0.43 Allowed 'Trans proline' 0 N--CA 1.466 -0.125 0 C-N-CA 122.676 2.25 . . . . 64.24 112.38 179.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 21.3 tt0 -142.25 74.31 1.44 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.231 -0.44 . . . . 62.24 110.94 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -95.13 -23.57 17.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.455 . . . . 74.01 110.894 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.32 -33.91 66.06 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.114 -0.494 . . . . 71.4 111.137 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -56.0 -26.83 49.72 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.728 -0.749 . . . . 62.21 112.461 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -108.95 19.65 29.98 Favored Glycine 0 N--CA 1.453 -0.223 0 C-N-CA 120.734 -0.746 . . . . 54.42 112.449 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -90.16 164.17 14.54 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.797 0.332 . . . . 72.23 110.864 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 69.5 m -91.02 168.63 11.51 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.296 -0.411 . . . . 73.24 110.87 -179.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -59.68 -32.02 70.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.174 -0.466 . . . . 73.44 110.868 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.1 pp -60.83 -42.82 98.47 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.124 -0.489 . . . . 72.33 110.926 -179.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -62.08 -43.18 99.38 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.213 -0.449 . . . . 72.14 110.923 179.91 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 13.0 t-105 -72.98 -31.34 64.47 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.254 -0.43 . . . . 71.22 110.908 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -60.24 -35.27 75.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.301 -0.409 . . . . 72.51 110.869 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.94 -36.63 84.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.151 -0.477 . . . . 74.32 110.905 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.13 -35.85 69.97 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.257 -0.429 . . . . 74.22 111.112 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -72.49 -42.95 64.32 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.222 -0.444 . . . . 73.12 110.91 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.68 -32.64 74.08 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.201 -0.454 . . . . 72.4 110.938 179.91 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -70.02 -41.87 73.74 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 75.11 110.933 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.407 ' HA ' ' HB2' ' A' ' 22' ' ' PHE . 6.5 mt -71.64 -32.82 68.37 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.131 -0.486 . . . . 75.43 110.841 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.437 ' HE2' ' HA ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -57.04 -37.53 71.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.217 -0.447 . . . . 75.45 110.885 179.918 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.437 ' HA ' ' HE2' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -85.01 -26.62 26.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.201 -0.454 . . . . 74.22 110.869 179.968 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.407 ' HB2' ' HA ' ' A' ' 19' ' ' LEU . 1.5 m-85 -59.53 -38.6 81.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.147 -0.478 . . . . 75.2 110.852 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 2.4 p90 -120.9 43.5 2.76 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.189 -0.46 . . . . 74.4 110.936 -179.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.2 mt 62.1 155.06 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.164 -0.471 . . . . 75.43 110.971 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -76.02 89.31 2.99 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.246 -0.434 . . . . 71.41 110.891 -179.909 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 12.4 t0 -96.33 108.89 21.47 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.117 -0.492 . . . . 74.25 110.802 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.66 -17.99 61.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.197 -0.456 . . . . 62.15 110.882 -179.825 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.88 -12.46 60.71 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.109 -0.496 . . . . 74.51 110.907 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.7 m -87.26 8.05 25.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.121 -0.491 . . . . 72.53 111.162 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.9 mmtp -51.62 159.57 0.75 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.25 -0.432 . . . . 74.12 110.89 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 63.78 158.89 0.08 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.253 -0.43 . . . . 74.52 110.898 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.76 -27.65 60.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.133 -0.485 . . . . 71.02 111.109 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 10.4 m-20 -53.53 -28.39 31.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.236 -0.438 . . . . 71.33 110.889 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.2 m -84.56 -31.33 24.43 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.151 -0.477 . . . . 74.02 110.878 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.583 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 32.5 tp -57.92 -44.29 86.76 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.108 -0.497 . . . . 74.54 110.927 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -57.14 -51.11 70.61 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.127 -0.488 . . . . 73.13 110.858 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.65 -36.33 83.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.172 -0.467 . . . . 71.12 111.153 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -66.51 -49.07 67.75 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.16 -0.473 . . . . 74.43 110.945 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.583 ' HG ' ' O ' ' A' ' 35' ' ' LEU . 11.3 mt -54.62 -38.2 66.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.268 -0.424 . . . . 74.44 110.925 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.7 mmmt -59.44 -45.87 90.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.159 -0.473 . . . . 74.2 110.877 179.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -69.91 -33.78 72.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.203 -0.453 . . . . 75.11 110.9 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -68.47 -46.86 68.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.111 -0.495 . . . . 63.43 110.902 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -57.66 -40.34 79.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.27 -0.423 . . . . 75.32 110.941 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.0 mmpt? -69.82 -25.7 63.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.255 -0.429 . . . . 75.11 110.877 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -70.08 -36.07 74.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.241 -0.436 . . . . 73.32 110.89 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 28.2 m-85 -80.49 -27.17 37.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.146 -0.479 . . . . 70.43 110.882 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.404 ' HA2' ' HB2' ' A' ' 206' ' ' SER . . . 102.53 -10.3 56.15 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.716 -0.754 . . . . 64.42 112.479 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.402 HD13 HG13 ' A' ' 50' ' ' ILE . 0.8 OUTLIER -65.56 140.52 97.57 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.566 0.698 . . . . 74.31 110.899 -179.927 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -69.73 -54.4 0.22 Allowed 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.662 2.241 . . . . 74.5 112.435 179.79 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.402 HG13 HD13 ' A' ' 48' ' ' LEU . 0.8 OUTLIER -50.4 108.25 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.189 -0.46 . . . . 72.24 111.166 179.865 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 73.6 p -121.96 159.04 27.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.189 -0.46 . . . . 73.25 111.178 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 82.92 -10.69 56.87 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.79 -0.719 . . . . 64.24 112.439 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 30.5 mtp -135.22 161.12 36.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.808 0.337 . . . . 75.23 110.842 -179.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.433 ' HA ' ' HB ' ' A' ' 58' ' ' VAL . 1.4 pp -160.15 129.42 5.09 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.192 -0.458 . . . . 74.32 110.967 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 p30 172.0 -29.04 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.193 -0.458 . . . . 61.31 110.924 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 2.7 m -97.54 -85.38 0.36 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.188 -0.46 . . . . 75.25 110.806 -179.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 18.6 tpt180 -84.46 -39.34 19.05 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.12 -0.491 . . . . 74.13 110.859 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.433 ' HB ' ' HA ' ' A' ' 54' ' ' LEU . 15.8 t -59.01 -43.94 90.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.261 -0.427 . . . . 72.2 111.064 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -74.38 -31.17 27.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.23 -0.441 . . . . 75.2 111.133 179.898 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.77 -33.06 71.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.465 . . . . 73.45 110.872 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.427 HG12 ' O ' ' A' ' 58' ' ' VAL . 0.6 OUTLIER -69.94 -29.68 41.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.137 -0.483 . . . . 74.52 111.128 -179.956 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 10.8 mtt -68.04 -35.17 77.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.178 -0.465 . . . . 74.01 110.888 179.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -86.9 -24.05 24.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.234 -0.439 . . . . 45.15 110.912 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.31 123.26 73.35 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.639 0.733 . . . . 75.32 110.801 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.77 147.2 62.27 Favored 'Trans proline' 0 N--CA 1.465 -0.181 0 C-N-CA 122.693 2.262 . . . . 72.11 112.373 179.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -150.4 -76.34 0.15 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.245 -0.434 . . . . 73.22 110.88 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -144.94 153.94 42.06 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.166 -0.47 . . . . 72.31 110.874 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.53 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -103.97 24.07 30.47 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.736 -0.745 . . . . 64.23 112.501 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -104.96 136.71 19.13 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 121.65 0.738 . . . . 74.23 111.063 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 162.21 42.92 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.683 2.255 . . . . 63.44 112.333 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -128.59 43.03 3.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.206 -0.452 . . . . 74.45 110.842 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -128.98 129.33 68.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.178 -0.464 . . . . 73.52 111.115 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -131.39 170.6 14.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.125 -0.489 . . . . 73.13 111.111 179.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -162.7 82.26 0.51 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.189 -0.46 . . . . 74.13 110.914 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 59.32 169.91 0.07 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.109 -0.496 . . . . 71.51 110.888 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -71.59 179.41 3.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.067 -0.515 . . . . 74.2 110.897 -179.834 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -144.78 -71.31 0.27 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.15 -0.477 . . . . 70.34 110.906 179.939 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . 0.569 ' CB ' ' CD ' ' A' ' 79' ' ' PRO . 2.7 m-85 -115.05 -66.88 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.633 0.73 . . . . 71.24 110.903 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.569 ' CD ' ' CB ' ' A' ' 78' ' ' PHE . 53.4 Cg_endo -69.8 159.05 54.8 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.608 2.205 . . . . 73.34 112.331 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -102.55 136.44 42.38 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.213 -0.449 . . . . 74.43 110.911 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.4 m 65.8 140.26 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.648 0.737 . . . . 70.4 110.835 -179.845 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 -48.82 0.63 Allowed 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.669 2.246 . . . . 72.25 112.306 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 2.3 mttp -77.72 171.4 15.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.239 -0.437 . . . . 72.53 110.922 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . 0.417 ' CD1' ' HA ' ' A' ' 200' ' ' LEU . 75.9 m95 -66.38 134.84 53.39 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.23 -0.441 . . . . 73.31 110.9 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 5.5 t -115.26 1.36 13.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.259 -0.428 . . . . 71.34 111.172 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -74.95 -178.85 3.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.252 -0.431 . . . . 73.12 110.842 -179.881 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 15.2 mttt -103.08 -8.78 20.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.136 -0.484 . . . . 71.12 110.861 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -153.54 144.92 14.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.258 -0.428 . . . . 74.14 111.097 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 97.4 t -123.62 130.34 74.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.171 -0.468 . . . . 72.25 111.118 179.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -116.2 156.34 26.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.164 -0.471 . . . . 75.51 111.097 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 4.8 p90 -147.09 146.84 30.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.254 -0.43 . . . . 70.51 110.967 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -151.15 135.56 16.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.1 -0.5 . . . . 74.3 110.832 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 13.7 mm -75.27 131.67 34.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.185 -0.461 . . . . 72.4 111.144 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 16.4 t -88.34 -40.21 13.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.462 . . . . 74.41 111.1 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 3.4 t -151.46 169.63 21.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.186 -0.461 . . . . 64.24 110.803 -179.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 11.5 p90 -130.16 154.16 47.8 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.124 -0.489 . . . . 74.1 110.909 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 3.4 t -102.3 141.64 34.8 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.099 -0.5 . . . . 75.33 111.109 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 4.8 mmp_? -52.63 -17.95 1.54 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.187 -0.46 . . . . 72.14 110.937 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.88 -36.87 85.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.156 -0.475 . . . . 74.13 110.862 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.7 mp -143.13 152.11 57.27 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-O 121.617 0.722 . . . . 72.52 110.932 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . 0.407 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.9 Cg_endo -69.71 151.03 69.27 Favored 'Trans proline' 0 C--O 1.233 0.226 0 C-N-CA 122.694 2.262 . . . . 73.11 112.38 179.866 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 3.3 t-160 -52.96 -26.59 15.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.251 -0.431 . . . . 74.11 110.91 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.407 HG22 ' HB2' ' A' ' 101' ' ' PRO . 0.0 OUTLIER -76.46 -39.23 33.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.178 -0.464 . . . . 74.02 111.078 -179.999 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 3.0 m -69.47 -39.67 77.56 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.146 -0.479 . . . . 54.24 111.11 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 72.4 t -72.74 -46.37 53.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.302 -0.408 . . . . 73.13 111.114 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.6 ' O ' HG21 ' A' ' 109' ' ' VAL . 59.7 t0 -58.45 -45.53 88.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.17 -0.468 . . . . 63.44 110.845 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 12.2 ptm180 -70.39 -34.08 72.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.222 -0.445 . . . . 75.02 110.797 -179.785 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.548 ' HB3' ' HD2' ' A' ' 188' ' ' PHE . 0.0 OUTLIER -60.87 -48.68 80.69 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.234 -0.439 . . . . 75.05 110.97 -179.999 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.6 HG21 ' O ' ' A' ' 106' ' ' ASP . 1.5 m -55.33 -41.47 61.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.152 -0.476 . . . . 72.31 111.11 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.462 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 47.0 t -70.11 -33.35 71.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.15 -0.477 . . . . 72.14 110.81 -179.775 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -61.56 -32.92 73.02 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.165 -0.47 . . . . 74.35 110.864 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.81 -40.15 9.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.246 -0.434 . . . . 74.32 111.134 179.773 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -65.1 -33.4 75.94 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.218 -0.446 . . . . 74.11 110.884 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -70.45 -42.63 71.26 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.208 -0.451 . . . . 75.15 110.884 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.5 -34.75 69.4 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.18 -0.464 . . . . 74.0 110.818 179.926 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 14.6 m95 -61.46 -50.12 74.04 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.252 -0.431 . . . . 75.23 110.906 -179.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . 0.596 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -73.08 -27.48 68.41 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.768 -0.73 . . . . 73.44 112.406 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.2 mmpt? -63.22 -15.18 56.23 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.791 0.329 . . . . 74.42 110.928 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.434 ' HG2' HD13 ' A' ' 226' ' ' LEU . 0.4 OUTLIER -107.57 14.08 26.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.189 -0.46 . . . . 75.55 110.862 -179.985 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.596 ' CG1' ' HA2' ' A' ' 117' ' ' GLY . 7.3 pt -147.08 155.64 47.06 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 121.668 0.747 . . . . 71.34 111.101 -180.0 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.76 3.7 2.62 Favored 'Trans proline' 0 C--N 1.342 0.226 0 C-N-CA 122.633 2.222 . . . . 75.35 112.391 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.43 ' HB3' ' H ' ' A' ' 123' ' ' HIS . 4.6 mt -60.59 -155.37 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.232 -0.44 . . . . 73.22 110.981 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.43 ' H ' ' HB3' ' A' ' 122' ' ' LEU . 65.9 t60 -167.81 149.0 5.31 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.266 -0.424 . . . . 74.12 110.86 179.87 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 43.9 m-85 -129.41 148.67 51.35 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.223 -0.444 . . . . 75.54 110.841 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . 0.407 ' HG2' ' N ' ' A' ' 126' ' ' LYS . 0.4 OUTLIER -126.22 143.19 51.23 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.13 -0.487 . . . . 75.14 110.919 -179.971 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . 0.407 ' N ' ' HG2' ' A' ' 125' ' ' ARG . 0.0 OUTLIER -80.7 140.34 35.65 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.201 -0.454 . . . . 74.04 110.875 -179.999 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 16.6 m -102.85 129.81 53.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.468 . . . . 50.13 111.082 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -142.31 -22.61 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.156 -0.475 . . . . 74.43 111.127 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -139.01 109.18 6.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.146 -0.479 . . . . 73.32 110.88 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 108.43 -160.73 13.61 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.711 -0.757 . . . . 62.11 112.466 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -102.0 155.56 18.09 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.795 0.331 . . . . 71.11 111.139 -179.862 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -112.23 165.47 12.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.201 -0.454 . . . . 72.32 111.057 179.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -71.53 -58.22 3.7 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.176 -0.466 . . . . 75.41 110.842 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 16.8 mm -85.11 107.96 16.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.226 -0.443 . . . . 71.04 111.123 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 8.4 mmm -95.29 121.0 36.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.152 -0.477 . . . . 72.43 110.869 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -106.9 97.79 6.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.306 -0.407 . . . . 70.04 111.099 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -129.36 165.96 21.83 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.725 -0.75 . . . . 63.34 112.533 179.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 82.4 m-85 -105.27 141.45 36.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.859 0.362 . . . . 74.01 110.893 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . 170.24 165.84 0.06 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.119 -0.491 . . . . 71.21 111.092 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.404 ' HB2' ' HB3' ' A' ' 149' ' ' PHE . 7.2 ptt180 -105.99 174.08 6.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.194 -0.457 . . . . 72.34 110.849 -179.888 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . 0.458 ' H ' ' HA ' ' A' ' 149' ' ' PHE . . . -55.71 -16.76 12.44 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.716 -0.754 . . . . 74.24 112.46 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -91.84 13.12 19.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.86 0.362 . . . . 75.03 111.117 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 4.3 p80 -79.21 -2.07 39.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.199 -0.455 . . . . 73.45 110.86 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 107.92 49.1 0.85 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.751 -0.738 . . . . 60.43 112.523 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -163.59 174.59 11.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.848 0.356 . . . . 72.14 110.802 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 47.1 p -63.9 -179.61 0.42 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.172 -0.467 . . . . 64.54 110.853 -179.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 65.34 119.97 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.627 0.727 . . . . 73.4 110.955 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.8 141.41 45.02 Favored 'Trans proline' 0 C--O 1.232 0.186 0 C-N-CA 122.734 2.29 . . . . 74.53 112.328 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 149' ' ' PHE . . . . . 0.482 ' O ' ' CG ' ' A' ' 150' ' ' ASP . 3.4 p90 -54.23 -40.71 67.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.275 -0.421 . . . . 70.0 110.879 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . 0.482 ' CG ' ' O ' ' A' ' 149' ' ' PHE . 2.8 p30 49.16 19.19 0.28 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.106 -0.497 . . . . 72.24 110.891 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . 0.423 ' C ' ' O ' ' A' ' 150' ' ' ASP . . . 35.97 -147.53 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.785 -0.721 . . . . 75.42 112.495 -179.942 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.68 145.27 57.09 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.721 2.28 . . . . 75.11 112.325 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . 0.456 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 106.45 -138.99 14.67 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.803 -0.713 . . . . 70.32 112.52 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 154' ' ' ASN . . . . . 0.456 ' C ' ' O ' ' A' ' 153' ' ' GLY . 3.7 p30 -33.8 136.05 0.12 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.896 0.379 . . . . 74.45 110.88 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 77.19 115.91 0.06 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.2 -0.455 . . . . 63.14 111.114 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . 0.483 HD13 HG13 ' A' ' 186' ' ' ILE . 0.6 OUTLIER -94.53 -53.39 3.92 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.209 -0.45 . . . . 75.02 110.894 179.961 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . 0.53 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -163.97 149.32 10.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.178 -0.464 . . . . 73.44 111.069 179.818 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 29.3 p-80 -109.13 123.6 49.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.256 -0.429 . . . . 74.34 110.903 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -110.54 152.6 26.19 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.248 -0.433 . . . . 74.42 111.067 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -108.01 169.85 8.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.191 -0.459 . . . . 75.31 110.862 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -107.98 164.23 15.23 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-O 121.624 0.726 . . . . 71.14 111.149 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.86 90.06 0.53 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.688 2.259 . . . . 74.44 112.315 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -144.43 141.72 10.36 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.779 -0.724 . . . . 72.32 112.514 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 74.3 m 64.79 -81.31 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.82 0.343 . . . . 73.1 111.135 -179.834 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -179.52 -70.19 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.721 -0.752 . . . . 74.03 112.489 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 166' ' ' LEU . . . . . 0.536 ' CD2' ' C ' ' A' ' 166' ' ' LEU . 0.0 OUTLIER -54.0 -21.57 8.49 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.815 0.341 . . . . 75.02 110.848 -179.9 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . 0.452 ' H ' HD12 ' A' ' 166' ' ' LEU . . . -80.38 -173.84 46.91 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.732 -0.747 . . . . 43.43 112.543 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 72.8 22.26 79.18 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.775 -0.726 . . . . 74.31 112.444 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -95.93 -174.21 3.05 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.798 0.333 . . . . 63.41 110.858 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -124.71 131.42 53.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.128 -0.487 . . . . 74.21 111.064 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 18.8 m170 -125.92 132.37 52.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.206 -0.452 . . . . 72.53 110.882 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 -114.35 140.26 48.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.195 -0.457 . . . . 71.44 110.911 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 57.8 t0 -73.43 101.59 3.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.138 -0.483 . . . . 74.11 110.881 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.34 -16.21 13.51 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.16 -0.473 . . . . 74.45 110.876 -179.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -79.11 -16.16 57.1 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.123 -0.49 . . . . 73.32 110.796 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 37.8 mm-40 -83.61 -175.88 6.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.262 -0.427 . . . . 71.41 110.922 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 54.4 mtm180 -111.59 116.86 31.52 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.225 -0.443 . . . . 74.32 110.881 -179.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 52.1 m95 -116.96 139.89 50.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.203 -0.453 . . . . 74.32 110.959 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 12.7 t -178.11 163.5 1.71 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.236 -0.438 . . . . 74.13 111.142 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -125.32 -70.13 0.76 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.29 -0.413 . . . . 61.52 110.946 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -62.83 -13.57 47.67 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.784 -0.722 . . . . 62.41 112.5 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 182' ' ' SER . . . . . 0.422 ' O ' ' C ' ' A' ' 183' ' ' SER . 0.4 OUTLIER -93.58 -24.41 17.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.859 0.361 . . . . 74.0 110.806 -179.677 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 183' ' ' SER . . . . . 0.422 ' C ' ' O ' ' A' ' 182' ' ' SER . 4.5 m 35.67 57.61 0.9 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.127 -0.488 . . . . 64.12 110.824 -179.776 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 4.2 tt -116.86 -33.62 4.72 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.124 -0.489 . . . . 74.43 110.837 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -117.99 -140.22 6.43 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.809 -0.71 . . . . 74.22 112.528 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 186' ' ' ILE . . . . . 0.483 HG13 HD13 ' A' ' 156' ' ' LEU . 5.5 mm -79.65 98.58 3.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 120.873 0.368 . . . . 73.22 111.149 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -47.09 120.52 3.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.15 -0.477 . . . . 71.31 110.892 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 188' ' ' PHE . . . . . 0.548 ' HD2' ' HB3' ' A' ' 108' ' ' LEU . 1.4 t80 -54.07 -35.41 62.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.137 -0.483 . . . . 75.45 110.902 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.11 -48.0 69.47 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.077 -0.51 . . . . 60.14 110.946 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -70.22 -40.23 74.63 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.152 -0.476 . . . . 74.22 110.906 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -70.62 -35.07 72.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.143 -0.48 . . . . 61.32 111.08 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 192' ' ' ALA . . . . . 0.528 ' O ' ' HB2' ' A' ' 196' ' ' LEU . . . -56.62 -44.62 81.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.246 -0.433 . . . . 52.32 111.114 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.47 -42.37 87.34 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.285 -0.416 . . . . 72.43 111.109 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 14.5 t-160 -73.36 -42.06 62.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.263 -0.426 . . . . 71.44 110.755 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -72.09 -48.59 42.91 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.299 -0.409 . . . . 71.01 111.132 179.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 196' ' ' LEU . . . . . 0.528 ' HB2' ' O ' ' A' ' 192' ' ' ALA . 4.4 mm? -65.73 -43.45 88.99 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.218 -0.447 . . . . 74.52 110.965 -179.955 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -57.34 -28.37 59.04 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.68 -0.771 . . . . 62.43 112.527 179.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 198' ' ' HIS . . . . . . . . . . . . . 6.1 m-70 -65.87 -32.84 74.58 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.777 0.322 . . . . 75.21 110.88 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -69.77 -20.84 63.47 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.265 -0.425 . . . . 73.13 110.847 -179.802 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 200' ' ' LEU . . . . . 0.417 ' HA ' ' CD1' ' A' ' 84' ' ' TRP . 0.3 OUTLIER -89.78 5.56 45.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.139 -0.482 . . . . 75.12 110.916 -179.98 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 83.6 -7.52 68.82 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.704 -0.76 . . . . 50.41 112.577 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 202' ' ' MET . . . . . . . . . . . . . 45.4 tpp -55.27 135.24 49.99 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.797 0.332 . . . . 71.04 110.853 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -113.53 158.94 13.97 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.75 -0.738 . . . . 64.44 112.465 -179.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 11.2 m170 -55.15 150.76 10.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.793 0.33 . . . . 74.32 110.86 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -117.51 162.57 17.76 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.149 -0.478 . . . . 72.42 110.84 -179.751 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 206' ' ' SER . . . . . 0.404 ' HB2' ' HA2' ' A' ' 47' ' ' GLY . 2.0 p -88.36 -4.0 58.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.089 -0.505 . . . . 72.22 110.879 -179.803 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -70.89 134.89 85.58 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.645 0.736 . . . . 65.11 110.825 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.85 -6.1 17.85 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.631 2.22 . . . . 74.53 112.362 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 -126.65 33.42 4.97 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.217 -0.447 . . . . 63.52 110.902 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 210' ' ' ALA . . . . . 0.439 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.28 145.77 26.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.148 -0.478 . . . . 64.4 111.063 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -73.31 -25.91 21.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.222 -0.445 . . . . 75.23 111.122 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -99.68 8.7 44.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.222 -0.444 . . . . 75.22 110.849 179.908 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 213' ' ' TYR . . . . . 0.431 ' CD1' ' HD2' ' A' ' 214' ' ' PRO . 0.3 OUTLIER -55.31 128.13 66.21 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.679 0.752 . . . . 73.43 110.955 -179.927 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 214' ' ' PRO . . . . . 0.431 ' HD2' ' CD1' ' A' ' 213' ' ' TYR . 54.2 Cg_endo -69.72 -18.54 37.13 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.738 2.292 . . . . 63.01 112.417 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 215' ' ' THR . . . . . 0.402 ' OG1' ' CD2' ' A' ' 213' ' ' TYR . 2.2 p -84.38 48.3 1.48 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.153 -0.476 . . . . 74.24 111.146 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -94.96 122.6 37.77 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.235 -0.439 . . . . 74.42 110.959 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . 177.32 -39.59 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.747 -0.739 . . . . 74.22 112.492 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 30.8 m-80 -60.58 -169.17 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.841 0.353 . . . . 64.22 110.915 -179.882 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . -50.93 105.11 0.17 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.784 -0.722 . . . . 73.55 112.478 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 220' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -75.4 153.56 85.89 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.685 0.755 . . . . 73.41 110.819 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.79 151.19 68.82 Favored 'Trans proline' 0 C--N 1.342 0.229 0 C-N-CA 122.655 2.236 . . . . 74.21 112.278 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -81.61 -27.61 34.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 75.43 110.902 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -115.09 -39.41 3.65 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.192 -0.458 . . . . 70.33 110.887 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER 67.28 136.38 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 71.11 110.899 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.64 159.61 42.15 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.182 -0.463 . . . . 65.02 110.919 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . 0.434 HD13 ' HG2' ' A' ' 119' ' ' GLU . 24.6 mt -60.21 149.12 34.05 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.287 -0.415 . . . . 62.53 110.882 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 227' ' ' SER . . . . . 0.439 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 1.0 OUTLIER -86.78 152.25 22.67 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.23 -0.441 . . . . 74.21 110.9 -179.927 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -65.19 -68.31 0.37 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.171 -0.468 . . . . 74.54 110.925 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -55.38 -24.97 32.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.174 -0.466 . . . . 74.2 110.826 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 4.9 t0 -69.51 -49.24 56.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.176 -0.465 . . . . 74.23 110.895 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 231' ' ' ILE . . . . . 0.413 HG12 ' HG2' ' A' ' 119' ' ' GLU . 9.2 mt -68.56 -42.63 83.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.203 -0.453 . . . . 73.41 111.211 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 232' ' ' LYS . . . . . 0.425 ' HG3' ' N ' ' A' ' 233' ' ' GLY . 0.2 OUTLIER -59.7 -32.08 70.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.084 -0.507 . . . . 73.32 110.915 179.844 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 233' ' ' GLY . . . . . 0.425 ' N ' ' HG3' ' A' ' 232' ' ' LYS . . . -69.02 -47.11 56.36 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.717 -0.754 . . . . 65.45 112.546 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 13.5 tt -72.59 -30.64 34.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.81 0.338 . . . . 74.41 111.147 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -66.82 -24.56 66.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.108 -0.496 . . . . 71.13 110.975 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 236' ' ' LYS . . . . . 0.469 ' HE3' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.16 -23.1 59.2 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.174 -0.466 . . . . 74.41 110.918 179.929 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 237' ' ' LEU . . . . . 0.469 ' HB2' ' HE3' ' A' ' 236' ' ' LYS . 10.5 tt -97.24 -38.41 9.69 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.202 -0.454 . . . . 75.41 110.926 179.869 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 238' ' ' TYR . . . . . . . . . . . . . 62.7 m-85 -92.35 -2.66 56.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 54.42 110.914 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -150.69 -118.17 0.84 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.734 -0.746 . . . . 72.22 112.431 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -139.91 122.71 16.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.829 0.347 . . . . 75.42 110.869 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -179.66 167.7 1.39 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.172 -0.467 . . . . 73.34 110.904 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 12.7 p -171.04 128.63 0.73 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.165 -0.47 . . . . 62.43 110.781 -179.754 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -178.58 -54.79 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.112 -0.495 . . . . 72.13 110.86 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 1.4 p -173.76 127.04 0.39 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.145 -0.479 . . . . 71.41 110.844 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.67 107.83 14.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.165 -0.47 . . . . 75.43 110.821 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 27.1 tttt 56.78 25.14 9.91 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 72.11 110.903 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.215 -0.448 . . . . 74.13 110.849 179.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 302' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' -2' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.128 0 CA-C-O 121.577 0.703 . . . . 73.02 110.924 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -1' ' ' PRO . . . . . 0.51 ' HB2' ' CD1' ' A' ' 0' ' ' LEU . 53.6 Cg_endo -69.72 -50.1 0.5 Allowed 'Trans proline' 0 C--O 1.232 0.222 0 C-N-CA 122.626 2.217 . . . . 73.21 112.367 179.867 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 0' ' ' LEU . . . . . 0.51 ' CD1' ' HB2' ' A' ' -1' ' ' PRO . 0.0 OUTLIER -144.4 159.47 51.69 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.635 0.731 . . . . 75.23 110.945 179.937 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . 0.448 ' HD2' ' HB2' ' A' ' 0' ' ' LEU . 53.9 Cg_endo -69.8 134.45 27.94 Favored 'Trans proline' 0 C--N 1.341 0.145 0 C-N-CA 122.707 2.271 . . . . 64.24 112.33 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 34.3 tt0 52.09 87.48 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.24 -0.436 . . . . 62.24 110.85 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 50.4 tt0 -95.11 -47.76 6.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.171 -0.468 . . . . 74.01 110.91 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -67.43 -34.04 76.4 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.132 -0.486 . . . . 71.4 111.147 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -57.29 -41.44 92.99 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.782 -0.723 . . . . 62.21 112.48 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -101.44 21.65 41.95 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.647 -0.787 . . . . 54.42 112.437 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -101.64 164.32 11.81 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.791 0.329 . . . . 72.23 110.882 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -52.36 151.57 3.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.453 . . . . 73.24 110.837 -179.777 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 24.9 pt-20 -62.97 -31.71 72.89 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.154 -0.475 . . . . 73.44 110.931 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.02 -37.44 87.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.129 -0.487 . . . . 72.33 110.907 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.559 HE21 ' N ' ' A' ' 12' ' ' TRP . 0.0 OUTLIER -69.63 -42.69 73.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.165 -0.47 . . . . 72.14 110.887 179.942 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.559 ' N ' HE21 ' A' ' 11' ' ' GLN . 19.0 t-105 -73.21 -31.36 64.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.211 -0.449 . . . . 71.22 110.958 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 62.5 mt-10 -73.41 -35.47 65.85 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.214 -0.448 . . . . 72.51 110.886 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -63.0 -40.97 99.39 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.139 -0.482 . . . . 74.32 110.939 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.78 -41.86 98.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.192 -0.458 . . . . 74.22 111.057 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -66.06 -43.15 88.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 73.12 110.9 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -71.07 -31.48 67.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.173 -0.467 . . . . 72.4 110.893 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -70.22 -35.8 74.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.149 -0.478 . . . . 75.11 110.917 -179.805 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -67.21 -26.24 66.51 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.162 -0.472 . . . . 75.43 110.921 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 6.3 ptmt -69.43 -32.64 71.73 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.145 -0.48 . . . . 75.45 110.895 179.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.3 ptp180 -86.75 -27.62 23.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.213 -0.449 . . . . 74.22 110.905 179.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.95 -24.29 64.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.162 -0.472 . . . . 75.2 110.955 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.518 ' O ' ' HB3' ' A' ' 70' ' ' PRO . 19.2 m-85 -120.46 -76.84 0.58 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.123 -0.489 . . . . 74.4 110.916 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 97.4 mt -150.01 133.9 16.91 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.08 -0.509 . . . . 75.43 110.895 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -84.92 89.37 7.56 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.167 -0.47 . . . . 71.41 110.961 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -125.11 136.26 53.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.097 -0.501 . . . . 74.25 110.827 179.912 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.3 t -79.14 -7.06 57.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.152 -0.476 . . . . 62.15 110.901 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -61.22 -38.76 87.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.138 -0.483 . . . . 74.51 110.891 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.1 m -92.29 9.44 33.92 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.17 -0.468 . . . . 72.53 111.099 -179.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 8.3 ttmt -59.33 99.99 0.07 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.213 -0.449 . . . . 74.12 110.884 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -178.28 147.03 0.41 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.192 -0.458 . . . . 74.52 110.894 179.968 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.97 -38.54 61.66 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.241 -0.436 . . . . 71.02 111.135 179.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -72.13 -26.18 62.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.216 -0.447 . . . . 71.33 110.892 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -66.5 -21.01 66.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.199 -0.455 . . . . 74.02 110.925 -179.868 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -59.99 -37.13 78.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.067 -0.515 . . . . 74.54 110.953 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -64.25 -51.34 64.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.21 -0.45 . . . . 73.13 110.886 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.82 -47.85 81.63 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.101 -0.5 . . . . 71.12 111.064 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 2.4 tttp -60.17 -38.62 83.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.281 -0.418 . . . . 74.43 110.931 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -54.6 -36.68 64.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.208 -0.451 . . . . 74.44 110.911 179.902 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.1 ttpp -58.89 -45.72 89.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.183 -0.462 . . . . 74.2 110.914 179.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -69.79 -37.34 76.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.22 -0.446 . . . . 75.11 110.908 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 6.7 ttt -68.6 -40.29 80.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.106 -0.497 . . . . 63.43 110.907 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -65.94 -42.36 90.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.241 -0.436 . . . . 75.32 110.889 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.0 mmpt? -63.37 -28.47 70.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.171 -0.468 . . . . 75.11 110.876 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 15.0 t80 -69.8 -36.84 76.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.218 -0.447 . . . . 73.32 110.915 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -81.2 -35.24 31.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.165 -0.471 . . . . 70.43 110.907 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 102.79 -6.11 51.6 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.733 -0.746 . . . . 64.42 112.465 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.413 HD12 HG13 ' A' ' 50' ' ' ILE . 0.6 OUTLIER -59.71 143.13 87.3 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.593 0.711 . . . . 74.31 110.962 -179.932 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.66 -53.92 0.25 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.712 2.275 . . . . 74.5 112.358 179.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.413 HG13 HD12 ' A' ' 48' ' ' LEU . 0.7 OUTLIER -51.58 108.09 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.146 -0.479 . . . . 72.24 111.157 179.939 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -109.61 160.63 16.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.257 -0.429 . . . . 73.25 111.128 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 57.67 18.51 31.61 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.815 -0.707 . . . . 64.24 112.483 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 10.1 mtt -124.76 161.14 27.07 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.753 0.311 . . . . 75.23 110.885 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 20.1 tp -157.87 96.5 1.49 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.186 -0.461 . . . . 74.32 110.855 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 174.77 -29.06 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.192 -0.458 . . . . 61.31 110.87 179.892 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 2.5 p -85.08 -99.63 0.06 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.155 -0.475 . . . . 75.25 110.876 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -84.84 -30.5 24.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.139 -0.482 . . . . 74.13 110.866 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 41.9 t -59.33 -43.75 90.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.193 -0.458 . . . . 72.2 111.144 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 2.9 mm -75.05 -31.33 24.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.172 -0.467 . . . . 75.2 111.1 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -66.1 -44.21 85.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.165 -0.471 . . . . 73.45 110.869 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 35.5 pt -66.29 -29.78 47.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.115 -0.493 . . . . 74.52 111.143 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 1.4 mmm -71.18 -33.2 69.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.166 -0.47 . . . . 74.01 110.885 179.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -88.09 -25.66 22.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.199 -0.455 . . . . 45.15 110.896 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.01 137.69 37.47 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.573 0.702 . . . . 75.32 110.897 179.999 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -69.79 113.2 3.3 Favored 'Trans proline' 0 C--O 1.232 0.217 0 C-N-CA 122.66 2.24 . . . . 72.11 112.349 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 4.6 ttm180 -106.87 -85.75 0.5 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.296 -0.411 . . . . 73.22 110.873 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -145.86 156.31 43.47 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.19 -0.459 . . . . 72.31 110.848 -179.929 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.544 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -96.63 16.78 60.43 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.739 -0.743 . . . . 64.23 112.468 -179.924 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -111.85 133.15 21.66 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.604 0.716 . . . . 74.23 111.091 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . 0.518 ' HB3' ' O ' ' A' ' 23' ' ' TYR . 54.1 Cg_endo -69.7 165.73 29.92 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.66 2.24 . . . . 63.44 112.367 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -120.52 38.51 3.98 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.234 -0.439 . . . . 74.45 110.859 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -139.12 129.59 32.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.167 -0.47 . . . . 73.52 111.102 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -131.03 170.49 14.42 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.145 -0.48 . . . . 73.13 111.06 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -146.69 129.82 16.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.22 -0.446 . . . . 74.13 110.913 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -51.21 167.34 0.08 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.208 -0.451 . . . . 71.51 110.89 -179.872 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.5 m 63.91 158.51 0.08 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.136 -0.484 . . . . 74.2 110.906 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.0 tp 63.36 16.19 9.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.177 -0.465 . . . . 70.34 110.948 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -135.48 160.03 69.38 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-O 121.651 0.739 . . . . 71.24 110.921 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 -175.0 1.02 Allowed 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.626 2.217 . . . . 73.34 112.37 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 20.9 m120 -98.9 149.0 23.38 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.272 -0.422 . . . . 74.43 110.812 -179.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 4.2 m 65.83 121.26 0.02 OUTLIER Pre-proline 0 C--N 1.33 -0.258 0 CA-C-O 121.628 0.728 . . . . 70.4 110.909 -179.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.79 -48.31 0.74 Allowed 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.726 2.284 . . . . 72.25 112.332 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.479 ' HD2' ' CD2' ' A' ' 237' ' ' LEU . 0.3 OUTLIER -89.61 165.34 14.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.237 -0.438 . . . . 72.53 110.855 179.929 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . 0.486 ' CD1' ' HA ' ' A' ' 200' ' ' LEU . 24.5 m95 -55.86 123.57 14.69 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.153 -0.476 . . . . 73.31 110.91 179.868 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -115.16 1.35 13.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.243 -0.435 . . . . 71.34 111.109 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -69.63 163.25 25.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.198 -0.455 . . . . 73.12 110.849 -179.874 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.92 -7.21 57.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.153 -0.476 . . . . 71.12 110.837 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -172.76 139.21 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.231 -0.441 . . . . 74.14 111.197 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 13.3 t -122.51 129.59 75.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 72.25 111.091 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 5.0 p -116.99 168.22 10.44 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.169 -0.468 . . . . 75.51 111.144 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.413 ' CD1' ' N ' ' A' ' 91' ' ' TYR . 2.5 p90 -145.26 146.56 31.72 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.259 -0.428 . . . . 70.51 110.909 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.409 ' HB2' ' HB2' ' A' ' 132' ' ' ALA . 3.4 ttt180 -147.04 132.09 18.23 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.148 -0.478 . . . . 74.3 110.831 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.4 HD11 ' HA ' ' A' ' 106' ' ' ASP . 3.9 mp -74.67 134.97 28.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.155 -0.475 . . . . 72.4 111.113 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.409 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 11.2 t -93.96 -40.63 11.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.198 -0.456 . . . . 74.41 111.163 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 1.4 t -139.45 164.03 30.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.136 -0.484 . . . . 64.24 110.881 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 11.2 p90 -113.54 152.52 30.12 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.115 -0.493 . . . . 74.1 110.911 -179.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' THR . . . . . 0.419 ' O ' ' O ' ' A' ' 100' ' ' LEU . 0.2 OUTLIER -82.74 141.02 32.7 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.126 -0.488 . . . . 75.33 111.119 -179.931 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 4.4 ppt_? -74.15 -7.08 51.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.243 -0.435 . . . . 72.14 110.868 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -96.4 -26.47 15.32 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.181 -0.463 . . . . 74.13 110.82 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.419 ' O ' ' O ' ' A' ' 97' ' ' THR . 0.6 OUTLIER -133.84 153.68 80.06 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-O 121.543 0.687 . . . . 72.52 110.954 -179.928 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . 0.416 ' HB2' HG23 ' A' ' 103' ' ' ILE . 53.9 Cg_endo -69.76 150.89 68.82 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.696 2.264 . . . . 73.11 112.322 179.82 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 16.0 t-160 -52.22 -26.21 11.14 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.138 -0.483 . . . . 74.11 110.825 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.416 HG23 ' HB2' ' A' ' 101' ' ' PRO . 13.9 tt -76.8 -39.2 30.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.199 -0.455 . . . . 74.02 111.122 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 3.4 m -69.46 -38.56 77.81 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.141 -0.481 . . . . 54.24 111.141 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 98.7 t -72.7 -45.08 58.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.275 -0.421 . . . . 73.13 111.152 179.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.589 ' O ' HG22 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -64.72 -42.42 95.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.21 -0.45 . . . . 63.44 110.823 179.931 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 13.8 ptm180 -70.14 -34.06 72.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.179 -0.464 . . . . 75.02 110.835 -179.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.551 ' HB3' ' HD2' ' A' ' 188' ' ' PHE . 0.0 OUTLIER -61.0 -48.84 79.95 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.221 -0.445 . . . . 75.05 110.961 179.95 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.589 HG22 ' O ' ' A' ' 106' ' ' ASP . 1.4 m -55.78 -41.66 66.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.204 -0.453 . . . . 72.31 111.082 179.867 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.471 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 13.5 t -70.1 -34.29 72.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.19 -0.459 . . . . 72.14 110.845 -179.841 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -62.44 -33.53 75.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.164 -0.471 . . . . 74.35 110.928 179.912 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -94.68 -40.2 9.93 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.165 -0.47 . . . . 74.32 111.068 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.86 -33.11 75.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.224 -0.444 . . . . 74.11 110.926 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -65.68 -36.4 83.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.164 -0.471 . . . . 75.15 110.887 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.58 -34.48 78.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.174 -0.466 . . . . 74.0 110.892 179.932 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' TRP . . . . . 0.619 ' O ' ' HG3' ' A' ' 119' ' ' GLU . 6.9 m95 -64.24 -49.48 71.77 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.199 -0.455 . . . . 75.23 110.946 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . 0.568 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -74.79 -19.41 79.92 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.802 -0.713 . . . . 73.44 112.45 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 5.6 mtmt -70.53 -14.01 62.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.739 0.304 . . . . 74.42 110.933 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.619 ' HG3' ' O ' ' A' ' 116' ' ' TRP . 2.3 pp20? -109.97 12.45 23.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.243 -0.435 . . . . 75.55 110.877 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.568 ' CG1' ' HA2' ' A' ' 117' ' ' GLY . 4.7 pt -144.25 142.98 20.69 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.64 0.733 . . . . 71.34 111.133 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 16.57 0.21 Allowed 'Trans proline' 0 C--O 1.233 0.268 0 C-N-CA 122.723 2.282 . . . . 75.35 112.33 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.476 ' H ' ' C ' ' A' ' 120' ' ' ILE . 5.2 mt -62.54 -158.07 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.301 -0.409 . . . . 73.22 110.908 -179.981 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.467 ' H ' ' HB3' ' A' ' 122' ' ' LEU . 3.4 t-160 -156.47 121.06 4.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.196 -0.456 . . . . 74.12 110.886 179.796 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 11.6 m-30 -109.88 148.69 31.09 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.205 -0.452 . . . . 75.54 110.905 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.03 142.16 49.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.105 -0.498 . . . . 75.14 110.852 -179.878 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.03 149.35 30.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.187 -0.46 . . . . 74.04 110.957 179.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 26.5 m -103.13 126.14 57.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.195 -0.457 . . . . 50.13 111.087 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -142.98 -9.81 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.204 -0.453 . . . . 74.43 111.157 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -157.31 108.97 2.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.164 -0.471 . . . . 73.32 110.936 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 109.1 -159.7 13.93 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.727 -0.749 . . . . 62.11 112.512 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 23.7 p -101.96 156.11 17.74 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.821 0.343 . . . . 71.11 111.153 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . 0.409 ' HB2' ' HB2' ' A' ' 92' ' ' ARG . . . -111.97 165.32 12.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.26 -0.427 . . . . 72.32 111.06 179.873 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -70.03 -65.37 0.73 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.137 -0.483 . . . . 75.41 110.877 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 3.9 mp -88.71 106.74 17.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.218 -0.446 . . . . 71.04 111.145 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' MET . . . . . 0.409 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 0.9 OUTLIER -91.49 128.36 37.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.219 -0.446 . . . . 72.43 110.897 179.838 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -106.01 97.6 5.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.302 -0.408 . . . . 70.04 111.1 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -130.18 157.73 22.09 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.727 -0.749 . . . . 63.34 112.479 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' PHE . . . . . 0.42 ' O ' ' CB ' ' A' ' 139' ' ' ALA . 2.7 m-85 -105.12 147.5 27.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.88 0.371 . . . . 74.01 110.89 -179.844 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.42 ' CB ' ' O ' ' A' ' 138' ' ' PHE . . . 166.81 166.56 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.196 -0.456 . . . . 71.21 111.102 179.923 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 47.4 mtm180 -104.74 173.06 6.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.205 -0.452 . . . . 72.34 110.867 -179.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -55.02 -20.73 21.4 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.793 -0.718 . . . . 74.24 112.46 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -65.42 -13.57 59.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.818 0.342 . . . . 75.03 111.136 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 2.0 p80 -68.65 -11.13 59.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 73.45 110.917 179.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 116.06 39.41 0.88 Allowed Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.752 -0.737 . . . . 60.43 112.468 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -117.91 142.84 46.89 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.755 0.312 . . . . 72.14 110.838 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 52.8 p -65.28 153.73 40.24 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 64.54 110.883 -179.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 64.88 134.61 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.674 0.75 . . . . 73.4 110.912 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.67 134.62 28.61 Favored 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.7 2.267 . . . . 74.53 112.362 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 149' ' ' PHE . . . . . 0.403 ' CE1' ' HB2' ' A' ' 173' ' ' ASP . 0.1 OUTLIER -69.21 -32.22 71.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.288 -0.414 . . . . 70.0 110.862 179.956 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 74.23 -1.45 3.07 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.119 -0.491 . . . . 72.24 110.835 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . 0.663 ' O ' 'CA ' ' A' ' 302' ' ' ' CA' . . . 51.04 -111.12 1.16 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.737 -0.744 . . . . 75.42 112.474 179.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.8 139.96 41.36 Favored 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.641 2.227 . . . . 75.11 112.378 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 103.5 -154.38 17.96 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.744 -0.741 . . . . 70.32 112.445 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -41.41 153.17 0.05 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.875 0.369 . . . . 74.45 110.864 -179.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 77.31 108.07 0.08 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.236 -0.438 . . . . 63.14 111.136 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . 0.457 HD11 HG13 ' A' ' 186' ' ' ILE . 0.5 OUTLIER -90.83 -53.49 4.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 75.02 110.93 179.953 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . 0.544 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -165.44 148.14 7.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.133 -0.485 . . . . 73.44 111.067 179.809 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 20.0 p-80 -105.75 123.8 48.53 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.156 -0.475 . . . . 74.34 110.903 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -111.33 154.04 25.13 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.274 -0.421 . . . . 74.42 111.094 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 17.7 m-85 -106.8 146.99 30.22 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.202 -0.454 . . . . 75.31 110.845 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -78.47 164.51 55.67 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 121.631 0.729 . . . . 71.14 111.015 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 162' ' ' PRO . . . . . 0.406 ' HB3' ' CE2' ' A' ' 84' ' ' TRP . 53.3 Cg_endo -69.77 78.12 1.03 Allowed 'Trans proline' 0 C--N 1.343 0.237 0 C-N-CA 122.734 2.29 . . . . 74.44 112.299 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -137.81 114.62 1.11 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.692 -0.766 . . . . 72.32 112.447 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 66.64 168.39 0.23 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.864 0.364 . . . . 73.1 111.143 -179.875 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -64.64 -48.17 75.69 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.695 -0.764 . . . . 74.03 112.474 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 10.1 tt -62.7 -40.01 95.81 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.846 0.355 . . . . 75.02 110.916 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -79.35 163.16 48.45 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.739 -0.743 . . . . 43.43 112.454 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 89.88 22.72 35.12 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.686 -0.769 . . . . 74.31 112.457 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -91.98 161.65 14.71 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.769 0.319 . . . . 63.41 110.888 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.38 130.46 55.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.231 -0.441 . . . . 74.21 111.076 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 4.8 m170 -126.61 158.46 36.24 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.198 -0.455 . . . . 72.53 110.826 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 58.8 m-85 -140.93 138.84 34.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.151 -0.477 . . . . 71.44 110.868 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 173' ' ' ASP . . . . . 0.403 ' HB2' ' CE1' ' A' ' 149' ' ' PHE . 66.7 t0 -70.39 96.77 1.18 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.155 -0.475 . . . . 74.11 110.884 179.923 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 2.2 pp20? -57.87 -16.62 12.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.174 -0.467 . . . . 74.45 110.878 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -79.43 -16.4 56.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.145 -0.48 . . . . 73.32 110.814 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 25.1 mm-40 -79.78 -174.91 4.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.262 -0.426 . . . . 71.41 110.839 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 39.6 mtm180 -111.23 111.17 22.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.128 -0.487 . . . . 74.32 110.874 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 12.5 m95 -117.13 145.03 44.06 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.253 -0.43 . . . . 74.32 110.953 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 7.2 t -178.58 163.79 1.55 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.265 -0.425 . . . . 74.13 111.079 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -123.09 -68.21 0.9 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 61.52 110.902 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -66.99 -10.83 57.23 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.761 -0.733 . . . . 62.41 112.479 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 182' ' ' SER . . . . . 0.449 ' O ' ' C ' ' A' ' 183' ' ' SER . 0.3 OUTLIER -97.36 -24.44 15.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.763 0.316 . . . . 74.0 110.802 -179.71 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 183' ' ' SER . . . . . 0.449 ' C ' ' O ' ' A' ' 182' ' ' SER . 1.3 m 32.93 61.69 0.38 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.178 -0.465 . . . . 64.12 110.826 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -116.82 -33.66 4.72 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.196 -0.456 . . . . 74.43 110.928 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -121.66 -135.38 4.74 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.743 -0.742 . . . . 74.22 112.486 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 186' ' ' ILE . . . . . 0.457 HG13 HD11 ' A' ' 156' ' ' LEU . 8.5 mm -79.41 97.58 2.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.784 0.326 . . . . 73.22 111.113 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -50.87 123.46 9.18 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.193 -0.458 . . . . 71.31 110.846 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 188' ' ' PHE . . . . . 0.551 ' HD2' ' HB3' ' A' ' 108' ' ' LEU . 1.5 t80 -54.27 -36.55 63.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.144 -0.48 . . . . 75.45 110.821 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.43 -47.55 69.88 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.189 -0.459 . . . . 60.14 110.922 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 40.4 t80 -69.37 -39.28 78.15 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.222 -0.445 . . . . 74.22 110.874 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -71.64 -35.49 70.42 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.122 -0.49 . . . . 61.32 111.091 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 192' ' ' ALA . . . . . 0.482 ' O ' ' HB2' ' A' ' 196' ' ' LEU . . . -56.48 -44.91 81.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.214 -0.448 . . . . 52.32 111.103 179.905 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.4 -41.75 90.18 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.2 -0.455 . . . . 72.43 111.193 -179.88 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 18.1 t-160 -72.7 -39.7 66.78 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.195 -0.457 . . . . 71.44 110.843 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -75.02 -48.1 25.77 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.215 -0.448 . . . . 71.01 111.077 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 196' ' ' LEU . . . . . 0.482 ' HB2' ' O ' ' A' ' 192' ' ' ALA . 4.5 mm? -62.22 -39.04 91.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.199 -0.455 . . . . 74.52 110.885 -179.892 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -61.24 -26.54 66.18 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.736 -0.745 . . . . 62.43 112.485 179.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 198' ' ' HIS . . . . . . . . . . . . . 6.9 m-70 -70.06 -32.21 70.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.831 0.348 . . . . 75.21 110.856 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -71.72 -21.25 61.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.199 -0.455 . . . . 73.13 110.823 -179.754 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 200' ' ' LEU . . . . . 0.486 ' HA ' ' CD1' ' A' ' 84' ' ' TRP . 0.3 OUTLIER -93.08 -2.44 55.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.154 -0.475 . . . . 75.12 110.974 179.988 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 90.55 -9.5 77.41 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.731 -0.747 . . . . 50.41 112.509 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 202' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.91 129.41 26.8 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.82 0.343 . . . . 71.04 110.858 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -101.02 159.37 18.9 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.734 -0.746 . . . . 64.44 112.451 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 17.5 m-70 -55.93 167.38 0.6 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.774 0.321 . . . . 74.32 110.914 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -129.32 154.14 47.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.242 -0.435 . . . . 72.42 110.873 -179.731 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -87.55 -4.64 58.97 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.178 -0.464 . . . . 72.22 110.821 -179.794 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.72 136.99 82.86 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-O 121.614 0.721 . . . . 65.11 110.927 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 -6.33 18.34 Favored 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.688 2.259 . . . . 74.53 112.375 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -128.05 30.11 5.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.23 -0.441 . . . . 63.52 110.887 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 210' ' ' ALA . . . . . 0.424 ' HA ' ' HB2' ' A' ' 227' ' ' SER . . . -87.17 145.44 26.42 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.204 -0.453 . . . . 64.4 111.122 179.84 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -68.22 -28.53 41.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.256 -0.429 . . . . 75.23 111.167 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 11.0 mtp -97.91 10.52 40.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.134 -0.484 . . . . 75.22 110.897 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 213' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -55.56 114.35 7.17 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.638 0.732 . . . . 73.43 110.926 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 -18.36 36.96 Favored 'Trans proline' 0 C--O 1.232 0.209 0 C-N-CA 122.687 2.258 . . . . 63.01 112.316 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.24 52.29 2.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.23 -0.441 . . . . 74.24 111.068 -179.893 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -68.8 124.34 23.42 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.26 -0.427 . . . . 74.42 110.906 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . 142.01 68.81 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.781 -0.724 . . . . 74.22 112.454 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -158.6 -53.15 0.06 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.862 0.363 . . . . 64.22 110.881 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . -133.57 158.29 23.17 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.738 -0.744 . . . . 73.55 112.459 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 220' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -120.19 101.42 47.06 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.592 0.71 . . . . 73.41 110.829 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.75 129.1 17.01 Favored 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.734 2.289 . . . . 74.21 112.328 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -81.39 -27.88 34.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.209 -0.451 . . . . 75.43 110.943 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 3.5 p30 -115.15 -39.92 3.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.181 -0.463 . . . . 70.33 110.876 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER 66.45 135.51 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.185 -0.462 . . . . 71.11 110.843 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -143.4 171.66 13.83 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.21 -0.45 . . . . 65.02 110.905 179.901 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . 0.41 HD12 ' HG2' ' A' ' 119' ' ' GLU . 25.5 mt -74.39 148.3 41.34 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.242 -0.435 . . . . 62.53 110.933 179.93 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 227' ' ' SER . . . . . 0.424 ' HB2' ' HA ' ' A' ' 210' ' ' ALA . 1.3 t -87.47 152.78 21.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.456 . . . . 74.21 110.873 -179.953 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 55.8 mt-30 -65.7 -64.77 0.78 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.137 -0.483 . . . . 74.54 110.928 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -55.85 -26.85 48.8 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 74.2 110.827 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -69.08 -50.06 51.69 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.192 -0.458 . . . . 74.23 110.901 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 231' ' ' ILE . . . . . . . . . . . . . 2.6 mm -69.93 -43.96 79.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.226 -0.443 . . . . 73.41 111.139 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 3.4 pttt -56.93 -32.69 66.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.168 -0.469 . . . . 73.32 110.847 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 233' ' ' GLY . . . . . 0.42 ' O ' ' HG3' ' A' ' 236' ' ' LYS . . . -65.52 -49.41 60.57 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.723 -0.751 . . . . 65.45 112.484 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 20.5 tt -73.77 -29.95 27.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.712 0.291 . . . . 74.41 111.075 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -62.3 -40.52 96.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.284 -0.417 . . . . 71.13 110.823 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 236' ' ' LYS . . . . . 0.428 ' HE2' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.24 -15.25 61.0 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.252 -0.431 . . . . 74.41 110.895 -179.99 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 237' ' ' LEU . . . . . 0.479 ' CD2' ' HD2' ' A' ' 83' ' ' LYS . 1.0 OUTLIER -96.57 -35.63 11.02 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.187 -0.46 . . . . 75.41 110.887 179.925 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 238' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -92.41 -35.58 13.6 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.221 -0.445 . . . . 54.42 110.911 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -118.48 -122.24 3.13 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.715 -0.755 . . . . 72.22 112.466 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.56 156.94 46.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.755 0.312 . . . . 75.42 110.894 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 10.5 mtm180 60.07 -169.55 0.15 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.206 -0.452 . . . . 73.34 110.963 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 68.29 12.0 8.58 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.262 -0.426 . . . . 62.43 110.904 -179.787 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 8.4 m120 -49.96 160.88 0.29 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.097 -0.501 . . . . 72.13 110.828 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 78.3 p -142.67 -169.85 3.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.109 -0.496 . . . . 71.41 110.86 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -91.83 -22.72 19.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.131 -0.486 . . . . 75.43 110.85 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 63.28 167.89 0.14 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.153 -0.476 . . . . 72.11 110.886 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.173 -0.467 . . . . 74.13 110.915 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 302' ' ' ' CA' . . . . . 0.663 'CA ' ' O ' ' A' ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' -2' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.23 0.037 0 CA-C-O 121.649 0.738 . . . . 73.02 110.967 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' -1' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 -11.74 31.46 Favored 'Trans proline' 0 C--O 1.233 0.229 0 C-N-CA 122.686 2.258 . . . . 73.21 112.349 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 7.9 mp -51.93 160.64 1.1 Allowed Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.561 0.696 . . . . 75.23 110.968 179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.72 -170.91 0.42 Allowed 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.681 2.254 . . . . 64.24 112.369 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -111.59 116.44 30.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.202 -0.454 . . . . 62.24 110.83 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -95.36 -20.24 19.29 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.135 -0.484 . . . . 74.01 110.872 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.35 -33.9 66.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.455 . . . . 71.4 111.168 179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -55.7 -32.97 59.06 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.769 -0.729 . . . . 62.21 112.416 -179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -108.95 21.59 27.12 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.755 -0.736 . . . . 54.42 112.518 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 1.6 ptt? -81.27 164.25 22.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.757 0.313 . . . . 72.23 110.93 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.7 m -86.99 168.74 13.06 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.259 -0.428 . . . . 73.24 110.888 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 60.3 tt0 -54.51 -31.86 56.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.107 -0.497 . . . . 73.44 110.892 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 8.2 mt -62.78 -42.82 99.87 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.145 -0.479 . . . . 72.33 110.908 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -63.19 -44.83 94.27 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.213 -0.449 . . . . 72.14 110.961 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 15.3 t-105 -70.82 -32.84 70.03 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.192 -0.458 . . . . 71.22 110.846 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -68.68 -35.46 77.24 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.282 -0.417 . . . . 72.51 110.939 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -62.94 -37.47 87.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.147 -0.479 . . . . 74.32 110.917 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.25 -40.15 77.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.209 -0.451 . . . . 74.22 111.087 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -70.98 -42.89 69.09 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 73.12 110.955 -179.91 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -67.44 -31.61 71.9 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.182 -0.463 . . . . 72.4 110.865 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 7.4 m-85 -66.53 -41.75 88.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.224 -0.444 . . . . 75.11 110.858 -179.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -71.36 -29.92 65.54 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.106 -0.497 . . . . 75.43 110.908 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.422 ' HE2' ' HA ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -61.44 -39.76 91.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.179 -0.464 . . . . 75.45 110.88 179.85 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.422 ' HA ' ' HE2' ' A' ' 20' ' ' LYS . 6.0 ptp180 -82.56 -27.72 31.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.226 -0.443 . . . . 74.22 110.911 179.957 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.0 m-30 -60.27 -15.87 28.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.189 -0.46 . . . . 75.2 110.897 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -120.52 -72.49 0.69 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.176 -0.465 . . . . 74.4 110.925 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 13.3 mt -160.38 -79.78 0.05 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.133 -0.485 . . . . 75.43 110.965 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -176.73 89.92 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.136 -0.484 . . . . 71.41 110.922 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -90.28 90.27 8.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.167 -0.47 . . . . 74.25 110.937 179.86 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 26.5 p -85.1 -34.82 22.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.21 -0.45 . . . . 62.15 110.854 -179.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -78.14 -22.13 49.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.113 -0.494 . . . . 74.51 110.883 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -88.14 9.12 23.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.136 -0.484 . . . . 72.53 111.114 -179.878 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.0 mttt -83.02 99.95 10.17 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.245 -0.434 . . . . 74.12 110.931 179.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -177.18 169.28 2.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.222 -0.445 . . . . 74.52 110.883 179.894 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.02 -32.19 66.91 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.145 -0.479 . . . . 71.02 111.166 179.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 15.0 m-80 -84.86 -49.03 8.75 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.469 . . . . 71.33 110.913 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 26.0 p -63.14 -26.45 68.82 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.156 -0.475 . . . . 74.02 110.844 -179.806 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.4 tt -58.1 -40.62 81.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.157 -0.474 . . . . 74.54 110.906 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.29 -51.41 63.65 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 73.13 110.817 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -55.3 -42.66 73.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.21 -0.45 . . . . 71.12 111.121 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.474 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.8 OUTLIER -70.38 -48.47 56.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.242 -0.436 . . . . 74.43 110.888 179.937 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.414 ' O ' ' HG2' ' A' ' 43' ' ' GLN . 4.3 mp -54.41 -37.29 64.91 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.258 -0.428 . . . . 74.44 110.945 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.6 tmmt? -58.63 -45.55 89.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.181 -0.463 . . . . 74.2 110.898 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.474 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 3.0 pt-20 -60.68 -32.79 71.98 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.225 -0.443 . . . . 75.11 110.849 -179.965 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 9.3 ttt -68.47 -33.72 74.67 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.143 -0.48 . . . . 63.43 110.909 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.436 ' HG3' ' HA ' ' A' ' 51' ' ' THR . 2.2 mm100 -61.63 -39.71 92.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.219 -0.446 . . . . 75.32 110.833 -179.888 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.2 mmpt? -71.6 -33.77 69.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.235 -0.439 . . . . 75.11 110.861 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 33.6 t80 -70.77 -40.26 72.75 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.231 -0.441 . . . . 73.32 110.94 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -81.76 -35.16 29.93 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.09 -0.505 . . . . 70.43 110.838 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 104.62 -10.08 49.05 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.719 -0.753 . . . . 64.42 112.469 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -62.37 134.54 94.9 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.661 0.743 . . . . 74.31 110.897 -179.902 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 -51.43 0.39 Allowed 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.627 2.218 . . . . 74.5 112.374 179.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -49.61 108.44 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.263 -0.426 . . . . 72.24 111.189 179.895 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.436 ' HA ' ' HG3' ' A' ' 43' ' ' GLN . 77.8 p -97.68 154.1 17.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.183 -0.462 . . . . 73.25 111.133 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 57.81 19.32 35.82 Favored Glycine 0 N--CA 1.453 -0.216 0 C-N-CA 120.724 -0.75 . . . . 64.24 112.445 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 12.8 mmt -101.43 161.12 13.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.811 0.338 . . . . 75.23 110.906 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.411 ' HA ' ' HB ' ' A' ' 58' ' ' VAL . 28.3 tp -172.21 84.66 0.07 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.215 -0.448 . . . . 74.32 110.884 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.3 t30 175.46 -28.86 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.134 -0.484 . . . . 61.31 110.88 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 30.9 t -89.42 -103.19 0.09 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.132 -0.486 . . . . 75.25 110.88 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.84 -25.12 28.28 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.182 -0.463 . . . . 74.13 110.956 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.442 ' O ' HG13 ' A' ' 61' ' ' ILE . 46.1 t -64.05 -42.15 94.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.166 -0.47 . . . . 72.2 111.141 179.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.9 mm -75.27 -31.66 24.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.162 -0.472 . . . . 75.2 111.117 179.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -59.69 -44.08 93.79 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.174 -0.466 . . . . 73.45 110.9 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.442 HG13 ' O ' ' A' ' 58' ' ' VAL . 1.4 pp -63.05 -29.48 47.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.142 -0.481 . . . . 74.52 111.164 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' MET . . . . . 0.408 ' N ' HG13 ' A' ' 61' ' ' ILE . 11.7 mmt -65.08 -36.73 85.24 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.207 -0.451 . . . . 74.01 110.808 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 15.8 pt20 -91.2 -26.25 19.14 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.306 -0.407 . . . . 45.15 110.877 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.16 125.4 70.3 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.548 0.69 . . . . 75.32 110.911 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.64 151.77 69.82 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.677 2.251 . . . . 72.11 112.351 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.14 -74.55 0.17 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.196 -0.457 . . . . 73.22 110.883 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 26.7 t -130.16 141.56 50.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.217 -0.447 . . . . 72.31 110.935 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.569 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -95.16 16.36 61.47 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.794 -0.717 . . . . 64.23 112.467 -179.909 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -125.63 145.4 51.26 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.57 0.7 . . . . 74.23 111.094 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.8 -179.85 3.22 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.727 2.285 . . . . 63.44 112.353 179.922 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -133.89 22.11 3.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.251 -0.431 . . . . 74.45 110.899 179.904 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.63 129.59 68.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.258 -0.428 . . . . 73.52 111.123 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -130.8 170.62 14.14 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.139 -0.482 . . . . 73.13 111.068 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -136.47 128.58 29.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.234 -0.439 . . . . 74.13 110.859 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -64.51 122.76 17.53 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.156 -0.475 . . . . 71.51 110.952 -179.868 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 179.99 100.45 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.159 -0.473 . . . . 74.2 110.821 -179.825 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 56.02 21.53 5.12 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.15 -0.477 . . . . 70.34 110.891 179.957 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -75.49 160.13 80.24 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.638 0.732 . . . . 71.24 110.939 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.75 -174.95 1.0 Allowed 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.661 2.241 . . . . 73.34 112.325 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -115.07 154.05 29.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.184 -0.462 . . . . 74.43 110.921 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 64.44 109.56 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.648 0.737 . . . . 70.4 110.833 -179.864 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 -49.11 0.59 Allowed 'Trans proline' 0 N--CA 1.465 -0.183 0 C-N-CA 122.696 2.264 . . . . 72.25 112.369 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.514 ' CG ' HD21 ' A' ' 237' ' ' LEU . 0.1 OUTLIER -88.83 150.48 22.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.189 -0.46 . . . . 72.53 110.883 179.925 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . 0.404 ' CD1' ' HA ' ' A' ' 200' ' ' LEU . 70.7 m95 -45.69 109.81 0.21 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.194 -0.457 . . . . 73.31 110.953 179.892 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 15.0 t -95.06 -6.65 41.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.261 -0.427 . . . . 71.34 111.17 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.1 m -65.67 177.94 1.13 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.257 -0.429 . . . . 73.12 110.856 -179.786 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 8.8 mmtp -96.26 -12.0 25.17 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.129 -0.487 . . . . 71.12 110.872 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -156.79 142.64 9.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.261 -0.427 . . . . 74.14 111.093 179.924 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 89.9 t -115.69 130.37 70.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.187 -0.461 . . . . 72.25 111.131 179.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.7 146.83 41.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.193 -0.458 . . . . 75.51 111.212 179.962 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 4.9 p90 -141.54 146.79 36.78 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.289 -0.414 . . . . 70.51 110.974 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 6.2 ttt180 -150.69 139.0 20.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.155 -0.475 . . . . 74.3 110.862 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 14.2 mm -75.13 125.35 34.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.212 -0.449 . . . . 72.4 111.116 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.442 ' HB ' ' HA3' ' A' ' 137' ' ' GLY . 5.7 t -83.0 -40.58 16.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.139 -0.482 . . . . 74.41 111.175 179.881 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -151.0 169.41 21.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.141 -0.482 . . . . 64.24 110.845 -179.882 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 11.1 p90 -129.72 153.2 48.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.125 -0.489 . . . . 74.1 110.902 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.9 t -101.55 141.68 34.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.121 -0.49 . . . . 75.33 111.122 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.66 -17.78 1.47 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.173 -0.467 . . . . 72.14 110.894 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -65.09 -35.47 81.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.185 -0.462 . . . . 74.13 110.813 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.8 mp -144.71 152.21 51.93 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 121.616 0.722 . . . . 72.52 110.907 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . 0.432 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.3 Cg_endo -69.78 151.11 68.88 Favored 'Trans proline' 0 C--O 1.231 0.143 0 C-N-CA 122.762 2.308 . . . . 73.11 112.321 179.845 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 3.3 t-160 -52.68 -26.71 14.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.222 -0.444 . . . . 74.11 110.815 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.432 HG22 ' HB2' ' A' ' 101' ' ' PRO . 2.5 tp -76.64 -39.53 32.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.276 -0.42 . . . . 74.02 111.106 -179.939 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 3.3 m -69.24 -39.9 78.2 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.152 -0.476 . . . . 54.24 111.215 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 70.6 t -72.62 -45.87 56.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.165 -0.47 . . . . 73.13 111.098 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.589 ' O ' HG22 ' A' ' 109' ' ' VAL . 59.7 t0 -58.56 -44.98 89.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.453 . . . . 63.44 110.844 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 14.4 ptm180 -70.2 -34.02 72.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.217 -0.447 . . . . 75.02 110.862 -179.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.55 ' HB3' ' HD2' ' A' ' 188' ' ' PHE . 0.0 OUTLIER -61.21 -49.56 76.65 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.133 -0.485 . . . . 75.05 110.901 -179.93 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.589 HG22 ' O ' ' A' ' 106' ' ' ASP . 1.4 m -55.99 -41.99 70.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.144 -0.48 . . . . 72.31 111.142 179.841 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.468 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 37.5 t -70.12 -34.16 72.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.19 -0.459 . . . . 72.14 110.869 -179.865 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.29 -32.86 73.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.12 -0.491 . . . . 74.35 110.923 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -95.63 -40.98 9.14 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.232 -0.44 . . . . 74.32 111.06 179.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.86 -33.15 75.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.278 -0.419 . . . . 74.11 110.856 -179.922 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 39.8 t30 -69.61 -39.14 77.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 75.15 110.844 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' MET . . . . . 0.411 ' O ' HD13 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -62.58 -34.78 77.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.165 -0.471 . . . . 74.0 110.964 179.868 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 7.0 m95 -62.41 -51.85 65.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.152 -0.476 . . . . 75.23 110.946 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . 0.557 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -73.42 -24.06 75.87 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.726 -0.75 . . . . 73.44 112.478 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 24.9 mtmt -67.75 -13.93 62.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.726 0.298 . . . . 74.42 110.883 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.438 ' HG2' HD11 ' A' ' 226' ' ' LEU . 0.4 OUTLIER -107.51 13.93 26.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.278 -0.419 . . . . 75.55 110.824 -179.996 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.557 ' CG1' ' HA2' ' A' ' 117' ' ' GLY . 7.5 pt -144.61 155.96 56.57 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.642 0.734 . . . . 71.34 111.141 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.79 4.68 2.06 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.681 2.254 . . . . 75.35 112.344 179.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.428 ' HB3' ' H ' ' A' ' 123' ' ' HIS . 4.9 mt -61.99 -156.36 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 73.22 110.88 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.428 ' H ' ' HB3' ' A' ' 122' ' ' LEU . 4.9 t60 -163.12 138.06 6.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.227 -0.442 . . . . 74.12 110.868 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -123.35 141.77 51.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.165 -0.471 . . . . 75.54 110.864 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -121.55 141.54 50.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.141 -0.481 . . . . 75.14 110.838 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.78 146.48 30.95 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.18 -0.464 . . . . 74.04 110.913 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 29.6 m -103.12 126.26 57.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.243 -0.435 . . . . 50.13 111.13 179.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -141.55 -16.8 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.193 -0.458 . . . . 74.43 111.111 179.925 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -147.21 109.1 4.41 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.199 -0.455 . . . . 73.32 110.949 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.69 -161.46 13.57 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.734 -0.746 . . . . 62.11 112.461 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.85 156.65 17.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.752 0.311 . . . . 71.11 111.176 -179.883 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -111.22 164.62 12.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.213 -0.449 . . . . 72.32 111.089 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.53 -57.75 5.32 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.235 -0.439 . . . . 75.41 110.878 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 20.8 mt -82.57 132.86 30.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.222 -0.444 . . . . 71.04 111.138 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' MET . . . . . 0.424 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 27.7 mmt -109.31 115.65 30.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.161 -0.472 . . . . 72.43 110.893 179.879 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -106.07 90.51 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.237 -0.438 . . . . 70.04 111.086 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . 0.442 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -129.84 167.96 21.43 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.735 -0.745 . . . . 63.34 112.45 179.905 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' PHE . . . . . 0.402 ' CD1' ' HG2' ' A' ' 174' ' ' GLU . 2.0 m-85 -105.39 149.62 25.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.869 0.366 . . . . 74.01 110.898 -179.843 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . 175.84 167.23 0.39 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.129 -0.487 . . . . 71.21 111.104 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 72.8 mtt180 -104.14 173.78 6.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.217 -0.447 . . . . 72.34 110.853 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -56.59 -15.79 13.53 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.736 -0.745 . . . . 74.24 112.532 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -99.86 14.57 29.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.722 0.296 . . . . 75.03 111.023 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 12.0 p80 -68.21 -33.45 74.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.246 -0.434 . . . . 73.45 110.875 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 147.13 47.01 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.808 -0.711 . . . . 60.43 112.475 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -158.49 149.86 20.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.829 0.347 . . . . 72.14 110.859 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 146' ' ' SER . . . . . 0.489 ' O ' ' CB ' ' A' ' 147' ' ' TYR . 37.6 m -63.66 98.39 0.18 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.166 -0.47 . . . . 64.54 110.847 -179.738 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 147' ' ' TYR . . . . . 0.489 ' CB ' ' O ' ' A' ' 146' ' ' SER . 0.2 OUTLIER 161.81 119.93 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.622 0.725 . . . . 73.4 110.939 -179.853 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.81 143.83 51.82 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.677 2.251 . . . . 74.53 112.324 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 149' ' ' PHE . . . . . 0.529 ' O ' ' CG ' ' A' ' 150' ' ' ASP . 0.2 OUTLIER -54.03 -22.73 11.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.133 -0.485 . . . . 70.0 110.845 -179.955 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . 0.529 ' CG ' ' O ' ' A' ' 149' ' ' PHE . 2.8 p30 50.12 18.55 0.4 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.227 -0.442 . . . . 72.24 110.818 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 41.17 -159.73 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.703 -0.761 . . . . 75.42 112.495 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 144.51 54.54 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.697 2.265 . . . . 75.11 112.382 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . 0.444 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 105.8 -134.33 12.05 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.699 -0.762 . . . . 70.32 112.535 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 154' ' ' ASN . . . . . 0.444 ' C ' ' O ' ' A' ' 153' ' ' GLY . 4.3 p30 -34.27 133.67 0.22 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.885 0.374 . . . . 74.45 110.888 -179.952 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 155' ' ' THR . . . . . 0.439 ' CB ' ' O ' ' A' ' 154' ' ' ASN . 1.3 m 80.25 105.35 0.07 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.186 -0.461 . . . . 63.14 111.147 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . 0.45 HD11 HG13 ' A' ' 186' ' ' ILE . 0.6 OUTLIER -91.7 -55.53 3.44 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.236 -0.438 . . . . 75.02 110.965 179.895 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . 0.569 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -158.45 148.4 19.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.186 -0.461 . . . . 73.44 111.161 179.771 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 24.2 p-80 -111.24 116.33 30.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.243 -0.435 . . . . 74.34 110.845 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -110.86 151.46 27.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.228 -0.442 . . . . 74.42 111.114 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -118.73 161.17 20.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.216 -0.447 . . . . 75.31 110.845 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -93.12 164.75 20.37 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.598 0.714 . . . . 71.14 111.061 179.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.86 84.43 0.67 Allowed 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.671 2.247 . . . . 74.44 112.323 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -115.21 117.1 3.9 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.718 -0.753 . . . . 72.32 112.507 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 2.5 m 72.68 -69.47 0.19 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.852 0.358 . . . . 73.1 111.162 -179.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . 179.08 -61.56 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.729 -0.748 . . . . 74.03 112.439 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 166' ' ' LEU . . . . . 0.528 ' CD2' ' C ' ' A' ' 166' ' ' LEU . 0.0 OUTLIER -53.91 -21.5 7.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.813 0.34 . . . . 75.02 110.898 -179.9 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . 0.433 ' H ' HD11 ' A' ' 166' ' ' LEU . . . -80.45 -171.5 43.68 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.736 -0.745 . . . . 43.43 112.473 179.908 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 72.88 21.11 80.01 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.723 -0.751 . . . . 74.31 112.523 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 76.8 m-20 -93.69 162.3 13.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.847 0.356 . . . . 63.41 110.889 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -113.34 131.35 55.99 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.145 -0.48 . . . . 74.21 111.064 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 25.3 m170 -124.88 137.16 54.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.245 -0.434 . . . . 72.53 110.857 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 35.7 m-85 -118.73 139.27 51.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.179 -0.464 . . . . 71.44 110.91 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 55.3 t0 -72.24 100.99 2.72 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.16 -0.473 . . . . 74.11 110.857 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 174' ' ' GLU . . . . . 0.402 ' HG2' ' CD1' ' A' ' 138' ' ' PHE . 0.6 OUTLIER -57.86 -16.08 10.58 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.217 -0.447 . . . . 74.45 110.919 -179.879 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -79.32 -16.25 56.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.119 -0.492 . . . . 73.32 110.938 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 36.4 mm-40 -83.24 -179.51 7.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.18 -0.463 . . . . 71.41 110.878 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 1.5 mtt85 -116.26 113.71 23.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.116 -0.493 . . . . 74.32 110.829 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 5.8 m95 -116.64 147.91 41.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.271 -0.422 . . . . 74.32 110.905 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 9.2 t -178.73 163.56 1.46 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.246 -0.433 . . . . 74.13 111.194 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -121.7 -71.27 0.74 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.201 -0.454 . . . . 61.52 110.864 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -61.0 -14.9 40.67 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.787 -0.72 . . . . 62.41 112.451 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 182' ' ' SER . . . . . 0.451 ' O ' ' C ' ' A' ' 183' ' ' SER . 0.2 OUTLIER -94.89 -24.33 17.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.926 0.394 . . . . 74.0 110.886 -179.717 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 183' ' ' SER . . . . . 0.451 ' C ' ' O ' ' A' ' 182' ' ' SER . 30.8 m 32.78 59.21 0.42 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.144 -0.48 . . . . 64.12 110.821 -179.869 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 1.3 tt -116.73 -33.58 4.77 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.146 -0.479 . . . . 74.43 110.897 179.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -117.94 -137.95 5.88 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.697 -0.763 . . . . 74.22 112.531 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 186' ' ' ILE . . . . . 0.45 HG13 HD11 ' A' ' 156' ' ' LEU . 9.4 mm -79.48 97.58 2.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.859 0.361 . . . . 73.22 111.128 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -48.41 119.92 3.33 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.139 -0.482 . . . . 71.31 110.871 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 188' ' ' PHE . . . . . 0.55 ' HD2' ' HB3' ' A' ' 108' ' ' LEU . 1.5 t80 -54.16 -36.0 62.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.179 -0.464 . . . . 75.45 110.837 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . 0.406 HD21 HD12 ' A' ' 108' ' ' LEU . 0.0 OUTLIER -67.55 -47.85 68.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.144 -0.48 . . . . 60.14 110.901 -179.928 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 54.6 t80 -69.5 -39.11 77.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.195 -0.457 . . . . 74.22 110.909 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -72.52 -34.59 67.71 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.129 -0.487 . . . . 61.32 111.165 179.791 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 192' ' ' ALA . . . . . 0.529 ' O ' ' HB2' ' A' ' 196' ' ' LEU . . . -56.17 -44.73 79.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.207 -0.451 . . . . 52.32 111.118 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -57.97 -41.32 82.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.193 -0.458 . . . . 72.43 111.184 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -73.02 -46.3 52.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.272 -0.422 . . . . 71.44 110.867 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -68.24 -47.71 67.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.187 -0.461 . . . . 71.01 111.141 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 196' ' ' LEU . . . . . 0.529 ' HB2' ' O ' ' A' ' 192' ' ' ALA . 4.4 mm? -64.67 -41.86 95.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.152 -0.476 . . . . 74.52 110.95 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -55.07 -30.93 55.57 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.749 -0.738 . . . . 62.43 112.532 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 198' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 -66.97 -33.48 75.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.684 0.278 . . . . 75.21 110.839 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 5.5 t -68.5 -20.4 64.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.231 -0.44 . . . . 73.13 110.9 -179.778 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 200' ' ' LEU . . . . . 0.404 ' HA ' ' CD1' ' A' ' 84' ' ' TRP . 0.3 OUTLIER -90.57 -2.6 57.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.065 -0.516 . . . . 75.12 110.866 -179.968 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 84.27 8.75 83.12 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.796 -0.716 . . . . 50.41 112.519 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 202' ' ' MET . . . . . . . . . . . . . 32.9 tpp -67.54 142.13 56.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.829 0.347 . . . . 71.04 110.877 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -104.7 159.16 16.06 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.715 -0.755 . . . . 64.44 112.487 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 13.7 m-70 -58.58 159.35 6.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.795 0.331 . . . . 74.32 110.855 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -121.09 150.05 41.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.251 -0.432 . . . . 72.42 110.817 -179.736 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 4.3 p -87.99 -4.2 58.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.157 -0.474 . . . . 72.22 110.846 -179.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.18 138.12 84.48 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.57 0.7 . . . . 65.11 110.879 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.84 -8.13 22.83 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.663 2.242 . . . . 74.53 112.319 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -126.56 29.36 5.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.221 -0.445 . . . . 63.52 110.941 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 210' ' ' ALA . . . . . 0.419 ' HA ' ' HB3' ' A' ' 227' ' ' SER . . . -87.36 145.53 26.28 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.156 -0.474 . . . . 64.4 111.109 179.908 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -68.1 -28.34 40.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.215 -0.448 . . . . 75.23 111.147 179.954 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 21.0 mmm -96.97 9.89 40.72 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.169 -0.468 . . . . 75.22 110.893 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 213' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -55.6 114.99 8.28 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-O 121.718 0.77 . . . . 73.43 110.949 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.72 -18.45 37.17 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.675 2.25 . . . . 63.01 112.316 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -84.34 51.54 2.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.225 -0.443 . . . . 74.24 111.128 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -71.99 122.84 21.55 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.279 -0.419 . . . . 74.42 110.894 -179.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . 167.92 -33.22 0.2 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.735 -0.745 . . . . 74.22 112.463 179.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -105.12 127.56 52.96 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.883 0.373 . . . . 64.22 110.951 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . 86.2 125.49 1.75 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.732 -0.747 . . . . 73.55 112.512 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 220' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -117.33 101.41 52.86 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.646 0.736 . . . . 73.41 110.879 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.73 117.56 5.16 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.723 2.282 . . . . 74.21 112.401 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.26 -22.03 42.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.267 -0.424 . . . . 75.43 110.957 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -116.91 -37.75 3.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.444 . . . . 70.33 110.931 -179.971 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER 65.88 129.28 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.167 -0.47 . . . . 71.11 110.858 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -143.54 161.63 37.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.168 -0.469 . . . . 65.02 110.828 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . 0.438 HD11 ' HG2' ' A' ' 119' ' ' GLU . 37.5 mt -66.52 148.26 52.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.193 -0.458 . . . . 62.53 110.895 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 227' ' ' SER . . . . . 0.419 ' HB3' ' HA ' ' A' ' 210' ' ' ALA . 0.0 OUTLIER -87.89 152.84 21.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.189 -0.459 . . . . 74.21 110.837 -179.94 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -65.58 -68.65 0.35 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.12 -0.491 . . . . 74.54 110.9 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 229' ' ' ASP . . . . . 0.401 ' O ' ' HG2' ' A' ' 232' ' ' LYS . 0.4 OUTLIER -56.3 -24.7 45.1 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.223 -0.444 . . . . 74.2 110.897 179.965 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 40.4 t0 -68.38 -49.84 57.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 74.23 110.868 180.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 231' ' ' ILE . . . . . 0.434 HG13 ' HG2' ' A' ' 119' ' ' GLU . 2.8 mm -69.82 -43.15 80.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.225 -0.443 . . . . 73.41 111.085 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 232' ' ' LYS . . . . . 0.401 ' HG2' ' O ' ' A' ' 229' ' ' ASP . 7.9 ptmt -57.58 -31.87 66.59 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.191 -0.459 . . . . 73.32 110.916 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -68.83 -45.54 64.09 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.714 -0.755 . . . . 65.45 112.486 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 5.5 tt -72.86 -34.36 46.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.724 0.297 . . . . 74.41 111.223 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -66.31 -26.89 67.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.116 -0.493 . . . . 71.13 110.956 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 236' ' ' LYS . . . . . 0.447 ' HE3' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.67 -22.48 58.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.169 -0.468 . . . . 74.41 110.927 179.925 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 237' ' ' LEU . . . . . 0.514 HD21 ' CG ' ' A' ' 83' ' ' LYS . 1.1 tp -97.24 -16.13 20.51 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.166 -0.47 . . . . 75.41 110.908 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 238' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -105.39 -35.19 7.59 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.189 -0.459 . . . . 54.42 110.946 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -107.71 -119.71 4.43 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.726 -0.75 . . . . 72.22 112.46 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 9.7 tttm -101.94 128.03 48.53 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.686 0.279 . . . . 75.42 110.922 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -52.03 141.75 17.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.256 -0.429 . . . . 73.34 110.862 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 30.5 p -163.97 27.36 0.08 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.153 -0.476 . . . . 62.43 110.923 -179.799 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -177.15 174.46 1.66 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.143 -0.481 . . . . 72.13 110.888 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -131.79 119.66 21.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.179 -0.464 . . . . 71.41 110.889 -179.842 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 1.5 ttt180 -162.46 126.89 3.16 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.149 -0.478 . . . . 75.43 110.836 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 12.8 mmtp -113.96 82.15 1.65 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.219 -0.446 . . . . 72.11 110.948 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 74.13 110.922 179.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 302' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' -2' ' ' LEU . . . . . 0.478 ' N ' ' HD2' ' A' ' -1' ' ' PRO . 4.4 mp . . . . . 0 C--O 1.231 0.094 0 CA-C-O 121.614 0.721 . . . . 73.02 110.976 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -1' ' ' PRO . . . . . 0.478 ' HD2' ' N ' ' A' ' -2' ' ' LEU . 53.4 Cg_endo -69.79 -170.84 0.42 Allowed 'Trans proline' 0 C--O 1.231 0.161 0 C-N-CA 122.647 2.231 . . . . 73.21 112.287 179.879 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 7.3 mp 59.02 72.71 0.78 Allowed Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.575 0.702 . . . . 75.23 110.889 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 -8.74 24.36 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.72 2.28 . . . . 64.24 112.331 179.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.4 pm0 -94.08 40.28 1.08 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.203 -0.453 . . . . 62.24 110.888 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -95.39 -23.64 17.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.161 -0.472 . . . . 74.01 110.86 -179.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.4 -34.04 66.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.162 -0.472 . . . . 71.4 111.1 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -55.83 -26.4 47.36 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.756 -0.735 . . . . 62.21 112.524 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -108.96 21.58 27.12 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.715 -0.755 . . . . 54.42 112.443 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 8.9 ptm -81.03 164.24 22.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.795 0.331 . . . . 72.23 110.909 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 12.6 m -114.1 168.71 9.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.253 -0.43 . . . . 73.24 110.866 -179.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -54.41 -32.58 57.59 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.121 -0.49 . . . . 73.44 110.855 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.0 tp -68.44 -38.12 80.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.166 -0.47 . . . . 72.33 110.901 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 66.1 mm-40 -68.13 -44.84 75.18 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.167 -0.469 . . . . 72.14 110.937 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 37.5 t-105 -71.9 -36.98 70.18 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.262 -0.426 . . . . 71.22 110.923 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -72.98 -35.37 66.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.238 -0.437 . . . . 72.51 110.906 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -63.41 -36.78 84.88 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.156 -0.475 . . . . 74.32 110.881 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.44 -34.87 77.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.223 -0.444 . . . . 74.22 111.14 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -66.07 -43.0 88.64 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.155 -0.475 . . . . 73.12 110.95 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -76.81 -34.1 57.94 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.152 -0.477 . . . . 72.4 110.884 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -70.7 -35.91 73.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.15 -0.477 . . . . 75.11 110.911 -179.864 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -68.31 -26.03 65.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.159 -0.473 . . . . 75.43 110.873 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.551 ' HA ' ' CE1' ' A' ' 23' ' ' TYR . 7.0 ptmt -68.87 -37.11 78.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.178 -0.464 . . . . 75.45 110.86 179.899 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.438 ' N ' ' HG2' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -79.4 -21.83 45.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.255 -0.43 . . . . 74.22 110.88 -179.996 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -55.41 -30.39 60.34 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.235 -0.439 . . . . 75.2 110.827 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.551 ' CE1' ' HA ' ' A' ' 20' ' ' LYS . 44.9 p90 -120.76 -51.26 2.15 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.104 -0.498 . . . . 74.4 110.923 -179.823 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.406 ' N ' ' CD2' ' A' ' 23' ' ' TYR . 10.0 mt -164.9 121.83 1.54 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.145 -0.48 . . . . 75.43 110.912 -179.965 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.452 ' HA ' ' HG3' ' A' ' 20' ' ' LYS . 0.4 OUTLIER -61.8 88.78 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.204 -0.453 . . . . 71.41 110.895 -179.971 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -125.5 130.24 51.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.164 -0.471 . . . . 74.25 110.825 179.922 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 13.1 t -82.48 -6.31 59.23 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.168 -0.469 . . . . 62.15 110.812 -179.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.43 -11.67 61.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.202 -0.453 . . . . 74.51 110.905 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 6.7 m -81.25 0.77 35.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.156 -0.475 . . . . 72.53 111.107 -179.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 22.7 mmtt -50.57 165.97 0.09 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.264 -0.426 . . . . 74.12 110.894 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 8.2 m120 65.43 151.3 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.192 -0.458 . . . . 74.52 110.912 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.01 -19.48 60.06 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.142 -0.481 . . . . 71.02 111.093 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -51.72 -45.39 63.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.22 -0.446 . . . . 71.33 110.923 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -86.87 -19.81 28.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.179 -0.464 . . . . 74.02 110.872 -179.884 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.543 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 35.1 tp -57.75 -45.34 86.0 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.104 -0.498 . . . . 74.54 110.891 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -56.76 -50.7 71.49 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.146 -0.479 . . . . 73.13 110.933 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.55 -36.59 83.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.202 -0.454 . . . . 71.12 111.089 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.43 -48.62 60.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.254 -0.43 . . . . 74.43 110.935 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' A' ' 35' ' ' LEU . 10.2 mt -54.42 -38.59 66.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.159 -0.473 . . . . 74.44 110.937 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.0 ttmm -58.75 -46.1 88.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.166 -0.47 . . . . 74.2 110.828 179.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -70.11 -33.35 71.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.221 -0.445 . . . . 75.11 110.842 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 4.2 ttt -68.27 -46.43 70.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.222 -0.445 . . . . 63.43 110.861 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -63.96 -41.77 97.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.254 -0.43 . . . . 75.32 110.911 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.4 mmtt -66.69 -25.44 66.54 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.147 -0.478 . . . . 75.11 110.837 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 38.2 t80 -69.66 -37.03 76.55 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.29 -0.414 . . . . 73.32 110.88 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 11.8 m-85 -81.27 -31.47 33.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.174 -0.466 . . . . 70.43 110.901 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 104.55 -10.1 49.34 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.776 -0.726 . . . . 64.42 112.469 180.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.411 HD12 HG13 ' A' ' 50' ' ' ILE . 0.5 OUTLIER -61.62 144.13 93.02 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.612 0.72 . . . . 74.31 110.922 -179.923 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.72 -54.66 0.21 Allowed 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.66 2.24 . . . . 74.5 112.307 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.411 HG13 HD12 ' A' ' 48' ' ' LEU . 0.8 OUTLIER -51.04 108.26 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.248 -0.433 . . . . 72.24 111.132 179.988 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 40.3 p -123.38 157.41 33.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.214 -0.448 . . . . 73.25 111.129 179.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 84.06 -10.85 59.49 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.742 -0.742 . . . . 64.24 112.491 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 1.2 mtt -135.16 156.81 48.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.895 0.379 . . . . 75.23 110.874 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.408 ' HA ' ' HB ' ' A' ' 58' ' ' VAL . 1.9 pp -156.99 129.15 7.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.2 -0.455 . . . . 74.32 110.917 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 173.87 -29.33 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.216 -0.447 . . . . 61.31 110.936 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 26.1 t -94.16 -89.15 0.23 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.116 -0.493 . . . . 75.25 110.859 -179.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 7.6 tpt180 -84.76 -35.99 22.05 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.118 -0.492 . . . . 74.13 110.919 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.446 ' O ' HG12 ' A' ' 61' ' ' ILE . 21.8 t -60.26 -41.73 88.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.132 -0.485 . . . . 72.2 111.132 179.941 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -74.67 -31.01 25.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.192 -0.458 . . . . 75.2 111.133 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -59.97 -43.79 94.88 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.128 -0.487 . . . . 73.45 110.921 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.446 HG12 ' O ' ' A' ' 58' ' ' VAL . 0.7 OUTLIER -65.92 -29.78 47.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.148 -0.478 . . . . 74.52 111.167 179.893 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 3.9 mmm -70.39 -33.75 71.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.133 -0.485 . . . . 74.01 110.889 179.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -88.08 -25.88 22.82 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.202 -0.454 . . . . 45.15 110.898 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.1 mtmp? -85.04 151.93 58.03 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.553 0.692 . . . . 75.32 110.927 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 143.68 51.57 Favored 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.695 2.264 . . . . 72.11 112.381 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 25.8 ttp180 -141.36 -85.52 0.18 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.273 -0.421 . . . . 73.22 110.855 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 16.2 p -145.67 143.75 29.99 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.233 -0.439 . . . . 72.31 110.894 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.573 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -89.08 11.87 68.01 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.683 -0.77 . . . . 64.23 112.466 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -116.93 141.4 28.25 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.577 0.703 . . . . 74.23 111.139 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.74 178.12 4.87 Favored 'Trans proline' 0 N--CA 1.465 -0.148 0 C-N-CA 122.719 2.28 . . . . 63.44 112.316 179.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -128.68 42.63 3.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.204 -0.453 . . . . 74.45 110.798 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -153.84 129.94 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.226 -0.443 . . . . 73.52 111.105 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -130.98 170.4 14.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.123 -0.489 . . . . 73.13 111.103 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -178.22 142.9 0.28 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.236 -0.438 . . . . 74.13 110.879 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 63.43 170.17 0.15 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.179 -0.464 . . . . 71.51 110.898 -179.913 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.5 m 65.83 115.52 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.11 -0.495 . . . . 74.2 110.8 -179.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -145.92 34.59 1.01 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.108 -0.496 . . . . 70.34 110.891 179.952 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . 0.484 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 0.6 OUTLIER -52.4 -59.95 7.44 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.632 0.729 . . . . 71.24 110.869 179.866 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.484 ' HD2' ' N ' ' A' ' 78' ' ' PHE . 53.5 Cg_endo -69.81 144.67 54.51 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.724 2.283 . . . . 73.34 112.303 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 16.7 m-80 -79.0 120.76 24.05 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.175 -0.466 . . . . 74.43 111.007 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 4.6 m 65.98 138.76 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.591 0.71 . . . . 70.4 110.873 -179.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 -15.09 36.76 Favored 'Trans proline' 0 C--N 1.341 0.151 0 C-N-CA 122.655 2.236 . . . . 72.25 112.311 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 5.1 mtpt -106.78 155.24 19.91 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.231 -0.441 . . . . 72.53 110.934 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . 0.422 ' NE1' ' O ' ' A' ' 199' ' ' SER . 38.4 m0 -50.11 112.33 0.66 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.21 -0.45 . . . . 73.31 110.938 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -115.37 -8.1 12.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.251 -0.432 . . . . 71.34 111.105 -179.894 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -59.57 176.13 0.29 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.23 -0.441 . . . . 73.12 110.84 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.34 -30.78 25.21 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.075 -0.512 . . . . 71.12 110.832 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.4 ' HA ' ' O ' ' A' ' 123' ' ' HIS . 0.3 OUTLIER -156.79 144.48 10.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.269 -0.423 . . . . 74.14 111.113 179.865 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 21.7 t -129.33 134.53 63.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.14 -0.482 . . . . 72.25 111.116 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 22.0 p -115.66 151.84 34.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.213 -0.449 . . . . 75.51 111.137 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 4.6 p90 -132.2 146.01 51.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.227 -0.442 . . . . 70.51 110.937 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 9.4 ttt180 -146.61 136.5 23.33 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.088 -0.505 . . . . 74.3 110.828 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.4 mm -75.87 134.18 29.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.154 -0.475 . . . . 72.4 111.092 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.431 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 15.1 t -92.29 -40.37 12.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.174 -0.466 . . . . 74.41 111.196 179.776 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -150.41 169.45 21.41 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.16 -0.473 . . . . 64.24 110.848 -179.863 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 16.7 p90 -132.24 155.25 48.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.201 -0.454 . . . . 74.1 110.926 -179.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 2.9 t -99.72 141.89 31.93 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.076 -0.511 . . . . 75.33 111.126 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.4 -18.02 1.45 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.195 -0.457 . . . . 72.14 110.876 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -65.02 -35.95 82.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.183 -0.462 . . . . 74.13 110.839 -180.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.8 mp -144.24 152.45 54.2 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.554 0.693 . . . . 72.52 110.959 179.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.79 151.07 68.77 Favored 'Trans proline' 0 C--O 1.232 0.216 0 C-N-CA 122.717 2.278 . . . . 73.11 112.32 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 -51.07 -26.66 6.67 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.173 -0.467 . . . . 74.11 110.901 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 10.5 tp -76.74 -38.45 30.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.181 -0.463 . . . . 74.02 111.101 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 3.2 m -68.86 -39.47 79.85 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.197 -0.456 . . . . 54.24 111.198 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 69.9 t -73.0 -45.29 55.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.21 -0.45 . . . . 73.13 111.101 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.594 ' O ' HG21 ' A' ' 109' ' ' VAL . 43.3 t0 -60.39 -44.96 95.16 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.213 -0.449 . . . . 63.44 110.903 179.873 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 11.5 ptm180 -70.15 -33.5 71.88 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.183 -0.462 . . . . 75.02 110.925 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.543 ' HB3' ' HD2' ' A' ' 188' ' ' PHE . 0.0 OUTLIER -60.68 -48.89 79.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.193 -0.458 . . . . 75.05 110.922 -179.984 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.594 HG21 ' O ' ' A' ' 106' ' ' ASP . 1.5 m -55.44 -41.68 63.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.156 -0.475 . . . . 72.31 111.197 179.845 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.465 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 47.7 t -70.11 -33.57 72.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.173 -0.467 . . . . 72.14 110.875 -179.902 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -61.96 -33.01 73.5 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.091 -0.504 . . . . 74.35 110.892 179.929 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.29 -40.32 9.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.26 -0.427 . . . . 74.32 111.049 179.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 6.4 tp -65.31 -32.54 74.25 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.29 -0.413 . . . . 74.11 110.884 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -65.37 -38.4 89.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.213 -0.449 . . . . 75.15 110.87 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.24 -34.48 76.58 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.232 -0.44 . . . . 74.0 110.883 179.856 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 7.1 m95 -67.04 -52.41 42.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.223 -0.444 . . . . 75.23 110.863 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -59.65 -37.87 92.93 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.718 -0.753 . . . . 73.44 112.522 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.1 mmpt? -61.34 -17.07 52.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.729 0.3 . . . . 74.42 110.872 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.426 ' HG2' HG13 ' A' ' 231' ' ' ILE . 0.5 OUTLIER -98.99 12.85 34.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.242 -0.436 . . . . 75.55 110.902 179.992 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 1.9 pt -148.28 145.76 21.35 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.711 0.767 . . . . 71.34 111.059 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.84 6.32 1.38 Allowed 'Trans proline' 0 C--N 1.343 0.249 0 C-N-CA 122.678 2.252 . . . . 75.35 112.341 179.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.1 mt -62.77 -156.95 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.203 -0.453 . . . . 73.22 110.962 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.4 ' O ' ' HA ' ' A' ' 88' ' ' VAL . 4.3 t60 -154.6 123.15 6.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.284 -0.416 . . . . 74.12 110.882 179.882 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 9.2 m-30 -108.23 133.14 52.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.224 -0.444 . . . . 75.54 110.868 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.29 141.66 48.78 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.165 -0.47 . . . . 75.14 110.921 -179.915 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.82 160.27 24.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.197 -0.456 . . . . 74.04 110.852 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 18.2 m -103.1 126.61 57.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.185 -0.462 . . . . 50.13 111.102 179.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -146.96 -13.35 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.157 -0.474 . . . . 74.43 111.138 179.896 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -153.65 109.05 3.2 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.173 -0.467 . . . . 73.32 110.89 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 102.45 -165.09 16.66 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.804 -0.712 . . . . 62.11 112.541 179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.99 155.67 18.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.824 0.345 . . . . 71.11 111.093 -179.835 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -112.37 165.7 11.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.213 -0.449 . . . . 72.32 111.06 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -76.34 -41.67 47.53 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.19 -0.459 . . . . 75.41 110.885 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 3.9 mm -94.76 107.83 19.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.185 -0.461 . . . . 71.04 111.146 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' MET . . . . . 0.431 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 9.3 mmm -98.59 122.5 41.87 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.152 -0.476 . . . . 72.43 110.929 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -106.28 95.23 3.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.262 -0.426 . . . . 70.04 111.162 179.99 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . 0.423 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -132.6 165.93 23.63 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.755 -0.736 . . . . 63.34 112.495 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -107.11 147.07 30.49 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.838 0.351 . . . . 74.01 110.872 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . 170.96 166.35 0.08 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.166 -0.47 . . . . 71.21 111.131 179.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 34.8 mtp180 -105.05 173.57 6.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.183 -0.462 . . . . 72.34 110.87 -179.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -53.51 -22.02 15.36 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.742 -0.742 . . . . 74.24 112.455 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -67.48 -10.9 55.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.827 0.346 . . . . 75.03 111.163 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 2.5 p80 -68.81 -11.91 60.94 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 73.45 110.865 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 118.63 39.57 0.71 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.736 -0.745 . . . . 60.43 112.454 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -123.3 141.1 52.33 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.748 0.309 . . . . 72.14 110.872 -179.952 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 3.0 m -64.23 156.03 30.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.219 -0.446 . . . . 64.54 110.902 -179.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 64.93 133.24 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.691 0.758 . . . . 73.4 110.881 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 134.67 28.52 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.712 2.275 . . . . 74.53 112.358 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -66.99 -29.69 69.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.26 -0.427 . . . . 70.0 110.865 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 75.21 -2.8 2.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.118 -0.492 . . . . 72.24 110.94 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . 0.636 ' O ' 'CA ' ' A' ' 302' ' ' ' CA' . . . 57.0 -117.3 9.31 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.718 -0.753 . . . . 75.42 112.475 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 138.9 38.82 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.649 2.233 . . . . 75.11 112.34 -179.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 103.16 -147.9 17.02 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.779 -0.724 . . . . 70.32 112.501 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -39.97 149.04 0.07 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.887 0.375 . . . . 74.45 110.9 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER 75.99 110.55 0.07 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.158 -0.474 . . . . 63.14 111.131 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . 0.442 HD11 HG13 ' A' ' 186' ' ' ILE . 0.6 OUTLIER -96.1 -53.35 3.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.133 -0.485 . . . . 75.02 110.882 179.995 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . 0.573 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -161.63 147.71 13.91 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.209 -0.451 . . . . 73.44 111.069 179.8 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 24.5 p-80 -109.63 125.72 52.88 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 74.34 110.86 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -109.41 171.25 7.55 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.193 -0.458 . . . . 74.42 111.105 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -125.9 153.28 44.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 75.31 110.856 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -86.27 165.46 33.54 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.605 0.717 . . . . 71.14 111.061 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 162' ' ' PRO . . . . . 0.467 ' HD3' ' O ' ' A' ' 199' ' ' SER . 53.7 Cg_endo -69.73 75.52 1.19 Allowed 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.696 2.264 . . . . 74.44 112.36 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -136.29 102.61 0.41 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.708 -0.758 . . . . 72.32 112.481 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 68.28 174.5 0.28 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.775 0.321 . . . . 73.1 111.135 -179.908 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -52.07 -50.65 44.55 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.739 -0.743 . . . . 74.03 112.502 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -58.71 -31.19 68.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.845 0.355 . . . . 75.02 110.915 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -72.97 151.22 45.42 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.669 -0.777 . . . . 43.43 112.481 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 86.2 15.99 63.57 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.782 -0.723 . . . . 74.31 112.472 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -87.37 147.88 25.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.791 0.329 . . . . 63.41 110.898 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.58 130.38 56.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 74.21 111.088 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 50.0 m170 -131.43 139.04 49.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.244 -0.435 . . . . 72.53 110.807 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 48.5 m-85 -122.34 140.07 53.08 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.184 -0.462 . . . . 71.44 110.858 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 63.5 t0 -69.14 98.25 0.99 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.196 -0.456 . . . . 74.11 110.853 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.94 -16.46 12.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.157 -0.474 . . . . 74.45 110.857 -179.886 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -79.25 -16.25 56.76 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.112 -0.494 . . . . 73.32 110.85 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 27.8 mm-40 -81.99 -176.78 6.31 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.166 -0.47 . . . . 71.41 110.918 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 32.3 mtm180 -116.49 114.4 24.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 74.32 110.917 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 5.7 m95 -117.24 150.33 38.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.244 -0.434 . . . . 74.32 110.855 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 12.2 t -179.82 163.87 1.16 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.231 -0.441 . . . . 74.13 111.14 -179.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -122.27 -67.53 0.95 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.253 -0.43 . . . . 61.52 110.839 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -67.49 -10.73 58.29 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.748 -0.739 . . . . 62.41 112.495 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 182' ' ' SER . . . . . 0.458 ' O ' ' C ' ' A' ' 183' ' ' SER . 0.2 OUTLIER -98.28 -24.51 15.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.856 0.36 . . . . 74.0 110.888 -179.768 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 183' ' ' SER . . . . . 0.458 ' C ' ' O ' ' A' ' 182' ' ' SER . 53.0 p 32.69 61.58 0.36 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.085 -0.507 . . . . 64.12 110.877 -179.83 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 6.0 tt -116.89 -33.7 4.68 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 74.43 110.894 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -121.33 -136.45 5.04 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.734 -0.746 . . . . 74.22 112.503 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 186' ' ' ILE . . . . . 0.442 HG13 HD11 ' A' ' 156' ' ' LEU . 7.7 mm -79.36 97.41 2.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.871 0.367 . . . . 73.22 111.165 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -50.94 121.32 5.84 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.154 -0.476 . . . . 71.31 110.879 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 188' ' ' PHE . . . . . 0.543 ' HD2' ' HB3' ' A' ' 108' ' ' LEU . 1.5 t80 -54.2 -35.68 62.64 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.224 -0.444 . . . . 75.45 110.913 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.37 -48.17 68.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.094 -0.503 . . . . 60.14 110.865 -179.998 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 9.7 t80 -69.88 -37.45 76.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.152 -0.476 . . . . 74.22 110.935 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -72.55 -35.9 68.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.099 -0.501 . . . . 61.32 111.092 179.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 192' ' ' ALA . . . . . 0.518 ' O ' ' HB2' ' A' ' 196' ' ' LEU . . . -57.13 -45.19 83.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.251 -0.431 . . . . 52.32 111.105 179.952 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.78 -41.03 85.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.189 -0.46 . . . . 72.43 111.162 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 13.9 t-160 -73.1 -44.97 59.66 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.215 -0.448 . . . . 71.44 110.872 179.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -69.48 -48.15 61.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.244 -0.435 . . . . 71.01 111.101 179.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 196' ' ' LEU . . . . . 0.518 ' HB2' ' O ' ' A' ' 192' ' ' ALA . 4.4 mm? -64.06 -39.42 94.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.114 -0.493 . . . . 74.52 110.909 -179.908 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -63.31 -25.15 68.13 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.745 -0.741 . . . . 62.43 112.526 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 198' ' ' HIS . . . . . . . . . . . . . 5.5 m-70 -68.7 -43.6 75.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.834 0.35 . . . . 75.21 110.857 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 199' ' ' SER . . . . . 0.467 ' O ' ' HD3' ' A' ' 162' ' ' PRO . 0.2 OUTLIER -58.83 -25.68 63.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.233 -0.439 . . . . 73.13 110.921 -179.788 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 200' ' ' LEU . . . . . 0.42 HD22 ' CE2' ' A' ' 84' ' ' TRP . 0.6 OUTLIER -85.05 1.13 49.11 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.104 -0.498 . . . . 75.12 110.891 -179.989 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 85.19 -9.36 67.02 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.787 -0.72 . . . . 50.41 112.525 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 202' ' ' MET . . . . . 0.441 ' CE ' ' HB ' ' A' ' 234' ' ' ILE . 0.0 OUTLIER -54.2 134.52 44.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.808 0.337 . . . . 71.04 110.828 -179.964 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -101.05 172.69 23.66 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.719 -0.753 . . . . 64.44 112.465 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 204' ' ' HIS . . . . . 0.416 ' HA ' ' HB3' ' A' ' 212' ' ' MET . 20.7 m-70 -67.45 163.64 20.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.827 0.346 . . . . 74.32 110.864 -179.96 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -124.66 153.47 42.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.223 -0.444 . . . . 72.42 110.856 -179.781 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 3.1 p -87.64 -4.27 58.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.156 -0.475 . . . . 72.22 110.819 -179.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.19 135.88 84.62 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.58 0.705 . . . . 65.11 110.924 179.952 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -69.83 -6.15 17.95 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.594 2.196 . . . . 74.53 112.292 -179.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -130.05 29.96 4.87 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.227 -0.442 . . . . 63.52 110.9 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 210' ' ' ALA . . . . . 0.47 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.27 145.33 26.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.142 -0.481 . . . . 64.4 111.09 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -67.21 -27.67 39.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.153 -0.476 . . . . 75.23 111.199 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 212' ' ' MET . . . . . 0.416 ' HB3' ' HA ' ' A' ' 204' ' ' HIS . 1.3 ttm -97.11 8.61 44.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.13 -0.486 . . . . 75.22 110.861 179.918 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 213' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -55.78 116.55 12.44 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.697 0.761 . . . . 73.43 110.845 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.89 -18.41 36.43 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.711 2.274 . . . . 63.01 112.282 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.7 51.1 2.05 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.239 -0.437 . . . . 74.24 111.139 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 8.4 t80 -77.14 128.8 35.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.265 -0.425 . . . . 74.42 110.974 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -164.34 -130.22 1.11 Allowed Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.669 -0.777 . . . . 74.22 112.421 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -51.78 149.99 4.35 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.879 0.371 . . . . 64.22 110.895 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . 87.69 99.59 0.89 Allowed Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.754 -0.736 . . . . 73.55 112.494 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 220' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -112.69 101.49 52.92 Favored Pre-proline 0 C--N 1.328 -0.356 0 CA-C-O 121.711 0.767 . . . . 73.41 110.865 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.72 124.83 11.48 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.652 2.234 . . . . 74.21 112.341 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -80.57 -20.54 43.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.258 -0.428 . . . . 75.43 110.87 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -129.32 37.24 4.05 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.183 -0.462 . . . . 70.33 110.87 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 224' ' ' PHE . . . . . 0.439 ' CD1' ' C ' ' A' ' 224' ' ' PHE . 0.3 OUTLIER -52.33 157.39 1.45 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.162 -0.472 . . . . 71.11 110.862 179.972 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 3.0 mttp -144.51 168.99 18.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.093 -0.503 . . . . 65.02 110.866 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . 0.408 HD11 ' HG2' ' A' ' 119' ' ' GLU . 21.9 mt -60.08 148.82 34.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 62.53 110.845 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 227' ' ' SER . . . . . 0.503 ' O ' HG12 ' A' ' 231' ' ' ILE . 0.0 OUTLIER -86.93 150.78 23.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.147 -0.479 . . . . 74.21 110.853 -179.95 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -64.38 -64.21 0.94 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.113 -0.494 . . . . 74.54 110.859 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -55.48 -26.92 45.21 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.174 -0.466 . . . . 74.2 110.864 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 61.7 t0 -69.73 -50.23 45.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.155 -0.475 . . . . 74.23 110.896 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 231' ' ' ILE . . . . . 0.503 HG12 ' O ' ' A' ' 227' ' ' SER . 3.9 mm -69.75 -40.59 79.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.183 -0.462 . . . . 73.41 111.154 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 232' ' ' LYS . . . . . 0.427 ' HG3' ' N ' ' A' ' 233' ' ' GLY . 0.0 OUTLIER -56.46 -31.93 64.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.222 -0.445 . . . . 73.32 110.918 179.835 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 233' ' ' GLY . . . . . 0.427 ' N ' ' HG3' ' A' ' 232' ' ' LYS . . . -64.82 -49.72 62.04 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.729 -0.748 . . . . 65.45 112.529 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 234' ' ' ILE . . . . . 0.441 ' HB ' ' CE ' ' A' ' 202' ' ' MET . 8.4 tt -72.99 -30.28 31.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 120.76 0.314 . . . . 74.41 111.104 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -61.46 -29.29 69.87 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.233 -0.439 . . . . 71.13 110.896 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 236' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.58 -25.46 59.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.267 -0.424 . . . . 74.41 110.887 -179.998 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 237' ' ' LEU . . . . . . . . . . . . . 9.7 tt -97.42 -26.22 14.93 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.259 -0.428 . . . . 75.41 110.899 179.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 238' ' ' TYR . . . . . 0.428 ' CD1' HG13 ' A' ' 234' ' ' ILE . 5.4 m-85 -92.44 -35.38 13.69 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.235 -0.439 . . . . 54.42 110.881 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -149.34 -118.23 0.92 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.735 -0.745 . . . . 72.22 112.482 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 15.8 ttmm -86.73 148.28 25.49 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.827 0.346 . . . . 75.42 110.878 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -80.29 -169.11 1.93 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.197 -0.456 . . . . 73.34 110.893 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 5.5 m -143.02 -69.9 0.33 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.247 -0.433 . . . . 62.43 110.874 -179.787 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -133.97 -41.44 0.83 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.11 -0.495 . . . . 72.13 110.954 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 63.22 99.14 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.146 -0.479 . . . . 71.41 110.837 -179.9 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 1.1 ttm180 -136.68 -66.01 0.54 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.172 -0.467 . . . . 75.43 110.912 -179.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 52.04 78.51 0.12 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.165 -0.471 . . . . 72.11 110.911 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 16.0 ptmt . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.194 -0.457 . . . . 74.13 110.874 179.877 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 302' ' ' ' CA' . . . . . 0.636 'CA ' ' O ' ' A' ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' -2' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.233 0.191 0 CA-C-O 121.624 0.726 . . . . 73.02 110.895 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' -1' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.76 172.08 13.29 Favored 'Trans proline' 0 C--O 1.232 0.221 0 C-N-CA 122.701 2.267 . . . . 73.21 112.332 179.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 11.8 tp -174.76 72.52 0.3 Allowed Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.525 0.678 . . . . 75.23 110.888 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.72 -179.63 3.03 Favored 'Trans proline' 0 C--O 1.231 0.154 0 C-N-CA 122.682 2.255 . . . . 64.24 112.356 179.83 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 39.58 40.86 0.67 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.211 -0.45 . . . . 62.24 110.873 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -95.44 -52.86 3.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.209 -0.451 . . . . 74.01 110.87 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -68.46 -33.97 75.12 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.214 -0.448 . . . . 71.4 111.076 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -55.9 -25.14 44.35 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.745 -0.741 . . . . 62.21 112.505 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -108.94 21.3 27.65 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.728 -0.749 . . . . 54.42 112.451 -179.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -84.74 164.2 18.69 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.812 0.339 . . . . 72.23 110.832 -179.938 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -112.45 168.24 9.8 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.206 -0.452 . . . . 73.24 110.911 -179.842 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -54.56 -31.92 57.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.183 -0.462 . . . . 73.44 110.95 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.72 -42.87 85.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.185 -0.461 . . . . 72.33 110.901 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -61.81 -42.53 99.13 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.125 -0.489 . . . . 72.14 110.913 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 6.5 t-105 -73.19 -33.26 65.31 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.207 -0.452 . . . . 71.22 110.847 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -63.96 -36.67 84.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.341 -0.39 . . . . 72.51 110.902 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -63.07 -36.89 85.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 74.32 110.897 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.16 -37.36 71.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.166 -0.47 . . . . 74.22 111.099 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -67.16 -43.0 83.38 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.2 -0.455 . . . . 73.12 110.917 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -70.08 -31.41 68.99 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.162 -0.472 . . . . 72.4 110.882 180.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 14.8 m-85 -67.68 -50.5 57.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.188 -0.46 . . . . 75.11 110.948 -179.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.417 ' HA ' ' HB2' ' A' ' 22' ' ' PHE . 2.8 tm? -67.82 -33.46 74.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.094 -0.503 . . . . 75.43 110.836 -179.94 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 4.9 tptt -57.15 -39.82 76.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.196 -0.456 . . . . 75.45 110.902 179.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.454 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 8.8 ptm180 -83.91 -25.29 30.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.242 -0.435 . . . . 74.22 110.917 179.912 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.417 ' HB2' ' HA ' ' A' ' 19' ' ' LEU . 0.4 OUTLIER -59.08 -20.17 50.93 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 75.2 110.865 -179.936 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.652 ' CE2' ' HB2' ' A' ' 24' ' ' LEU . 3.8 p90 -120.57 -49.54 2.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.182 -0.463 . . . . 74.4 110.958 -179.868 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.652 ' HB2' ' CE2' ' A' ' 23' ' ' TYR . 49.5 mt -166.38 -119.76 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.127 -0.488 . . . . 75.43 110.912 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.481 ' HB2' ' O ' ' A' ' 24' ' ' LEU . 0.3 OUTLIER 175.24 89.36 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.195 -0.457 . . . . 71.41 110.914 -179.957 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 62.1 m-20 -125.3 90.28 3.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.126 -0.488 . . . . 74.25 110.868 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.3 p -50.07 -28.21 6.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.243 -0.435 . . . . 62.15 110.876 -179.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -56.01 -33.17 64.64 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.057 -0.519 . . . . 74.51 110.877 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 87.5 m -79.98 -20.39 45.63 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.172 -0.467 . . . . 72.53 111.084 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.7 tttt -50.99 103.61 0.06 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.209 -0.45 . . . . 74.12 110.867 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -175.42 164.84 3.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.222 -0.444 . . . . 74.52 110.878 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.56 -37.34 63.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.147 -0.478 . . . . 71.02 111.121 179.826 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -69.58 -47.56 63.16 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.179 -0.464 . . . . 71.33 110.865 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.12 -22.98 62.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.185 -0.462 . . . . 74.02 110.829 -179.876 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.419 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 1.3 tt -58.76 -44.35 90.57 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.197 -0.456 . . . . 74.54 110.861 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -57.24 -52.64 64.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.268 -0.424 . . . . 73.13 110.931 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.48 -36.76 84.83 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.153 -0.476 . . . . 71.12 111.1 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.455 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 2.7 mmtm -65.19 -49.13 70.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.189 -0.46 . . . . 74.43 110.861 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 35' ' ' LEU . 4.6 mt -62.64 -35.54 79.93 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.209 -0.45 . . . . 74.44 110.874 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 26.0 tttt -60.1 -45.6 92.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.191 -0.459 . . . . 74.2 110.888 179.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 1.7 pt-20 -60.56 -32.73 71.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.192 -0.458 . . . . 75.11 110.877 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 13.9 ttt -65.68 -34.05 77.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.145 -0.48 . . . . 63.43 110.887 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.413 ' HG3' ' HA ' ' A' ' 51' ' ' THR . 2.7 mm-40 -64.11 -39.65 94.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.239 -0.437 . . . . 75.32 110.847 -179.929 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.2 mmpt? -68.52 -29.21 67.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.192 -0.458 . . . . 75.11 110.915 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -70.05 -42.31 73.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 73.32 110.923 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 10.4 m-85 -82.1 -35.33 28.7 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.206 -0.452 . . . . 70.43 110.803 -179.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 104.74 -10.15 48.68 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.718 -0.753 . . . . 64.42 112.414 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.66 138.57 93.05 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.607 0.718 . . . . 74.31 110.941 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.73 -53.25 0.28 Allowed 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.643 2.229 . . . . 74.5 112.386 179.844 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -52.39 108.23 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.242 -0.435 . . . . 72.24 111.137 179.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.413 ' HA ' ' HG3' ' A' ' 43' ' ' GLN . 68.2 p -116.22 168.53 10.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.214 -0.448 . . . . 73.25 111.174 179.917 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 65.19 12.51 55.52 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.763 -0.732 . . . . 64.24 112.495 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.2 ppp? -124.72 161.12 27.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.836 0.35 . . . . 75.23 110.868 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 18.4 tp -162.53 94.03 0.86 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.213 -0.449 . . . . 74.32 110.933 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 172.9 -26.13 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.122 -0.49 . . . . 61.31 110.927 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 44.3 m -89.34 -100.5 0.09 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.171 -0.468 . . . . 75.25 110.851 -179.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 12.9 tpt180 -84.62 -28.23 26.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.126 -0.488 . . . . 74.13 110.874 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 97.3 t -62.68 -41.33 91.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.218 -0.446 . . . . 72.2 111.112 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 1.8 mm -74.97 -31.58 25.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.177 -0.465 . . . . 75.2 111.167 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -60.06 -44.12 94.95 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 73.45 110.86 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 24.4 pt -70.34 -30.01 41.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.175 -0.466 . . . . 74.52 111.147 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 2.1 mmm -67.77 -35.26 78.38 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.144 -0.48 . . . . 74.01 110.832 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -87.67 -24.06 24.02 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.209 -0.451 . . . . 45.15 110.861 -179.874 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 50.5 mtmt -85.02 113.88 52.61 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.596 0.712 . . . . 75.32 110.864 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.78 148.05 64.07 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.71 2.273 . . . . 72.11 112.361 179.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 1.5 ppt_? -154.7 -59.48 0.11 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.252 -0.431 . . . . 73.22 110.829 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -146.14 144.88 30.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.215 -0.448 . . . . 72.31 110.884 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.554 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -101.75 15.37 57.09 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.781 -0.723 . . . . 64.23 112.491 -179.922 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -101.86 137.0 19.41 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.642 0.734 . . . . 74.23 111.111 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.82 165.41 31.12 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.632 2.221 . . . . 63.44 112.387 179.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -135.01 46.27 2.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.253 -0.43 . . . . 74.45 110.867 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -140.06 129.78 28.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.263 -0.426 . . . . 73.52 111.066 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -130.9 170.44 14.42 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.103 -0.498 . . . . 73.13 111.073 179.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -164.14 172.77 13.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.256 -0.429 . . . . 74.13 110.881 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 51.7 t80 -51.6 104.2 0.08 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.129 -0.487 . . . . 71.51 110.907 -179.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.5 p -140.98 178.43 7.37 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.1 -0.5 . . . . 74.2 110.852 -179.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 7.9 mt -95.96 53.95 1.44 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.121 -0.491 . . . . 70.34 110.906 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -78.04 160.18 74.26 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.655 0.741 . . . . 71.24 110.831 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 133.95 26.78 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.677 2.251 . . . . 73.34 112.336 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -51.26 137.07 23.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.191 -0.458 . . . . 74.43 110.91 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 63.65 94.8 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.689 0.757 . . . . 70.4 110.894 -179.836 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.7 -50.51 0.46 Allowed 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.661 2.24 . . . . 72.25 112.308 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.418 ' HD2' ' CD2' ' A' ' 237' ' ' LEU . 5.4 mttp -63.34 151.02 41.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.269 -0.423 . . . . 72.53 110.898 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . 0.5 ' CD1' ' HG3' ' A' ' 162' ' ' PRO . 39.7 m0 -50.97 109.49 0.33 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.198 -0.455 . . . . 73.31 110.961 179.902 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -105.02 -14.7 15.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.25 -0.432 . . . . 71.34 111.183 -179.957 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -58.16 153.5 14.82 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.188 -0.46 . . . . 73.12 110.897 -179.879 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 14.6 mmtp -65.91 -30.62 71.24 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.178 -0.465 . . . . 71.12 110.91 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -154.79 142.25 12.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.208 -0.451 . . . . 74.14 111.132 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 54.8 t -123.61 139.21 50.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.183 -0.462 . . . . 72.25 111.082 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 31.6 p -115.96 147.12 41.5 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.113 -0.494 . . . . 75.51 111.099 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 17.5 p90 -131.36 146.6 52.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.21 -0.45 . . . . 70.51 110.971 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 9.1 ttt180 -147.71 138.47 23.31 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.082 -0.508 . . . . 74.3 110.897 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 9.8 mm -75.21 135.09 27.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.223 -0.444 . . . . 72.4 111.156 179.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.456 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 21.1 t -91.47 -40.27 12.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.187 -0.461 . . . . 74.41 111.142 179.829 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 35.1 t -151.05 169.36 22.02 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.196 -0.456 . . . . 64.24 110.807 -179.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 13.2 p90 -131.86 155.09 48.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.078 -0.51 . . . . 74.1 110.95 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.7 t -103.32 141.71 35.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.129 -0.487 . . . . 75.33 111.14 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 2.1 mmt180 -52.53 -18.45 1.72 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.214 -0.448 . . . . 72.14 110.842 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.03 -37.42 87.54 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.199 -0.455 . . . . 74.13 110.86 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -142.09 152.4 61.45 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.594 0.711 . . . . 72.52 110.895 -179.957 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . 0.4 ' HB2' HG21 ' A' ' 103' ' ' ILE . 54.4 Cg_endo -69.71 151.21 69.3 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.724 2.283 . . . . 73.11 112.311 179.832 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -52.96 -26.29 14.68 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.196 -0.457 . . . . 74.11 110.814 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.4 HG21 ' HB2' ' A' ' 101' ' ' PRO . 5.5 tt -77.1 -39.51 29.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.312 -0.403 . . . . 74.02 111.124 179.9 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' THR . . . . . 0.4 ' CB ' ' HG2' ' A' ' 101' ' ' PRO . 3.4 m -69.12 -36.79 77.87 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.241 -0.436 . . . . 54.24 111.177 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 57.5 t -71.27 -42.15 74.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.172 -0.467 . . . . 73.13 111.165 179.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.59 ' O ' HG22 ' A' ' 109' ' ' VAL . 22.9 t0 -68.66 -38.21 80.25 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.217 -0.447 . . . . 63.44 110.928 179.888 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . 0.497 ' HG3' ' N ' ' A' ' 108' ' ' LEU . 0.0 OUTLIER -70.0 -33.49 72.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.153 -0.476 . . . . 75.02 110.869 -179.869 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.499 ' HB3' ' HD1' ' A' ' 188' ' ' PHE . 0.0 OUTLIER -64.64 -47.76 77.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.188 -0.46 . . . . 75.05 110.993 179.929 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.59 HG22 ' O ' ' A' ' 106' ' ' ASP . 1.3 m -55.16 -41.32 59.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 72.31 111.201 179.797 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.464 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 44.8 t -70.0 -34.67 73.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.174 -0.466 . . . . 72.14 110.892 -179.906 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -63.46 -34.64 78.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.11 -0.496 . . . . 74.35 110.887 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -92.27 -40.42 10.96 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.233 -0.44 . . . . 74.32 111.069 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 9.2 tp -64.4 -32.59 74.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.224 -0.444 . . . . 74.11 110.977 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 39.7 t30 -66.66 -38.77 87.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.209 -0.45 . . . . 75.15 110.886 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.84 -34.7 74.97 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.167 -0.469 . . . . 74.0 110.906 179.906 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' TRP . . . . . 0.415 ' O ' HG12 ' A' ' 120' ' ' ILE . 8.7 m95 -68.52 -38.81 81.22 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.186 -0.461 . . . . 75.23 110.872 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . 0.451 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -73.64 -33.91 57.48 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.76 -0.733 . . . . 73.44 112.456 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.7 -15.04 57.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.722 0.296 . . . . 74.42 110.863 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -106.25 13.56 28.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.264 -0.426 . . . . 75.55 110.954 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.529 ' C ' ' H ' ' A' ' 122' ' ' LEU . 7.3 pt -149.79 142.48 15.83 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.635 0.731 . . . . 71.34 111.157 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -69.86 25.32 0.18 Allowed 'Trans proline' 0 C--O 1.232 0.201 0 C-N-CA 122.641 2.228 . . . . 75.35 112.321 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.529 ' H ' ' C ' ' A' ' 120' ' ' ILE . 14.3 mt -81.49 -159.42 0.27 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.206 -0.452 . . . . 73.22 110.934 179.97 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 4.1 t60 -157.25 137.26 12.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.237 -0.438 . . . . 74.12 110.929 179.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . 0.401 ' CE2' ' HA3' ' A' ' 117' ' ' GLY . 20.9 m-85 -117.68 138.23 52.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.197 -0.456 . . . . 75.54 110.931 -179.897 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -118.27 141.48 48.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.149 -0.478 . . . . 75.14 110.821 -179.815 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.55 154.63 27.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.171 -0.468 . . . . 74.04 110.915 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 19.5 m -103.38 126.91 57.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.189 -0.46 . . . . 50.13 111.132 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -145.13 -25.99 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.208 -0.451 . . . . 74.43 111.152 179.901 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -139.76 109.27 6.22 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.176 -0.465 . . . . 73.32 110.877 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 103.0 -167.48 17.17 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.682 -0.77 . . . . 62.11 112.469 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -101.76 156.15 17.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.741 0.305 . . . . 71.11 111.158 -179.842 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -111.72 165.29 12.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.246 -0.433 . . . . 72.32 111.135 179.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -74.45 -44.57 51.12 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.242 -0.436 . . . . 75.41 110.893 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 3.8 mm -89.39 113.3 25.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 71.04 111.172 179.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' MET . . . . . 0.456 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 8.4 mmm -101.82 122.59 44.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.177 -0.465 . . . . 72.43 110.877 179.864 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -107.0 93.42 2.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 70.04 111.123 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -130.17 173.1 20.03 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.709 -0.757 . . . . 63.34 112.418 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 51.4 m-85 -108.48 149.83 28.26 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.854 0.359 . . . . 74.01 110.904 -179.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . 170.35 166.12 0.07 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.165 -0.47 . . . . 71.21 111.118 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.451 ' HB2' ' CB ' ' A' ' 149' ' ' PHE . 1.9 ptt180 -109.59 174.14 6.0 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.234 -0.439 . . . . 72.34 110.908 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -55.34 -18.93 15.53 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.676 -0.773 . . . . 74.24 112.53 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -91.43 13.18 18.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.793 0.33 . . . . 75.03 111.082 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 2.2 p80 -77.91 -15.75 58.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.212 -0.449 . . . . 73.45 110.855 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 128.27 49.62 0.15 Allowed Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.74 -0.743 . . . . 60.43 112.492 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -153.26 169.55 22.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.827 0.346 . . . . 72.14 110.863 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.38 165.47 11.81 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.216 -0.447 . . . . 64.54 110.902 -179.799 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 12.6 m-85 64.75 134.07 0.04 OUTLIER Pre-proline 0 C--N 1.327 -0.377 0 CA-C-O 121.724 0.773 . . . . 73.4 110.919 -179.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 151.35 68.85 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.674 2.249 . . . . 74.53 112.337 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 149' ' ' PHE . . . . . 0.475 ' C ' ' H ' ' A' ' 151' ' ' GLY . 10.4 p90 -53.19 -44.63 68.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.265 -0.425 . . . . 70.0 110.861 -179.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 75.52 -21.23 0.31 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.088 -0.506 . . . . 72.24 110.882 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . 0.475 ' H ' ' C ' ' A' ' 149' ' ' PHE . . . 68.04 -139.83 35.06 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.726 -0.749 . . . . 75.42 112.434 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.69 142.43 48.2 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.647 2.231 . . . . 75.11 112.357 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . 0.449 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 104.38 -143.47 15.69 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.768 -0.73 . . . . 70.32 112.437 179.918 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 154' ' ' ASN . . . . . 0.449 ' C ' ' O ' ' A' ' 153' ' ' GLY . 4.1 p30 -34.52 141.23 0.06 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.922 0.392 . . . . 74.45 110.867 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 75.72 117.88 0.06 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.126 -0.488 . . . . 63.14 111.098 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . 0.471 HD12 HG13 ' A' ' 186' ' ' ILE . 1.2 tp -107.07 -51.8 2.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.464 . . . . 75.02 110.955 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . 0.554 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -154.67 149.58 26.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.209 -0.45 . . . . 73.44 111.025 179.787 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 29.3 p-80 -116.39 110.94 19.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.172 -0.467 . . . . 74.34 110.816 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -110.95 170.3 8.19 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.313 -0.403 . . . . 74.42 111.118 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -146.65 164.35 32.94 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.208 -0.451 . . . . 75.31 110.868 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -93.74 164.99 18.96 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.498 0.666 . . . . 71.14 111.16 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 162' ' ' PRO . . . . . 0.5 ' HG3' ' CD1' ' A' ' 84' ' ' TRP . 54.1 Cg_endo -69.76 77.23 1.08 Allowed 'Trans proline' 0 C--O 1.231 0.169 0 C-N-CA 122.726 2.284 . . . . 74.44 112.35 -179.942 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -112.41 120.42 5.29 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.741 -0.742 . . . . 72.32 112.457 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 1.2 m 76.17 -58.97 0.52 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.789 0.328 . . . . 73.1 111.148 -179.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . 172.1 -56.49 0.17 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.784 -0.722 . . . . 74.03 112.483 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 1.3 tt -60.81 -18.08 53.37 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.83 0.348 . . . . 75.02 110.925 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -71.03 176.91 36.25 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.757 -0.735 . . . . 43.43 112.494 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 76.47 13.63 83.22 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.711 -0.757 . . . . 74.31 112.536 -179.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -94.05 149.69 21.01 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.822 0.344 . . . . 63.41 110.887 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.33 130.9 55.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.249 -0.432 . . . . 74.21 111.148 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 62.9 m170 -128.05 132.75 49.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.218 -0.446 . . . . 72.53 110.906 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 172' ' ' PHE . . . . . 0.406 ' HA ' ' HB1' ' A' ' 157' ' ' ALA . 30.3 m-85 -112.04 139.2 47.75 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.216 -0.447 . . . . 71.44 110.919 -179.898 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -70.22 99.74 1.57 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.206 -0.452 . . . . 74.11 110.869 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.78 -16.67 12.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.231 -0.441 . . . . 74.45 110.893 -179.896 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 -76.25 -16.07 59.88 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.182 -0.463 . . . . 73.32 110.859 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -87.95 -176.22 5.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 71.41 110.88 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 48.0 mtm180 -110.83 119.74 40.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.158 -0.474 . . . . 74.32 110.93 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 48.9 m95 -117.04 139.16 51.03 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.256 -0.429 . . . . 74.32 110.934 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 7.1 t -177.33 163.51 2.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.267 -0.424 . . . . 74.13 111.151 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -125.65 -68.55 0.83 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.233 -0.44 . . . . 61.52 110.916 179.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -65.26 -11.16 51.34 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.745 -0.74 . . . . 62.41 112.416 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 182' ' ' SER . . . . . 0.438 ' O ' ' C ' ' A' ' 183' ' ' SER . 1.5 m -97.34 -24.42 15.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.833 0.349 . . . . 74.0 110.907 -179.831 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 183' ' ' SER . . . . . 0.438 ' C ' ' O ' ' A' ' 182' ' ' SER . 12.1 m 34.82 61.76 0.57 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.147 -0.479 . . . . 64.12 110.88 -179.824 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -116.9 -33.59 4.71 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.067 -0.515 . . . . 74.43 110.942 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -122.3 -136.38 4.9 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.671 -0.776 . . . . 74.22 112.442 179.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 186' ' ' ILE . . . . . 0.471 HG13 HD12 ' A' ' 156' ' ' LEU . 8.2 mm -79.41 99.53 3.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.814 0.34 . . . . 73.22 111.138 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -50.29 121.79 6.06 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.18 -0.464 . . . . 71.31 110.844 -179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 188' ' ' PHE . . . . . 0.499 ' HD1' ' HB3' ' A' ' 108' ' ' LEU . 1.7 t80 -53.85 -34.84 60.54 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.207 -0.451 . . . . 75.45 110.905 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.25 -47.46 70.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 60.14 110.905 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 13.1 m-30 -69.47 -41.44 76.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.226 -0.443 . . . . 74.22 110.893 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -68.38 -35.91 78.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.177 -0.465 . . . . 61.32 111.094 179.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 192' ' ' ALA . . . . . 0.471 ' O ' ' HB2' ' A' ' 196' ' ' LEU . . . -58.56 -44.61 89.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.199 -0.455 . . . . 52.32 111.125 179.919 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -58.24 -42.9 87.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.152 -0.476 . . . . 72.43 111.178 -179.904 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 8.0 t-160 -72.84 -41.64 64.59 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.215 -0.448 . . . . 71.44 110.876 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -71.44 -47.92 52.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 71.01 111.095 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 196' ' ' LEU . . . . . 0.476 HD22 ' N ' ' A' ' 196' ' ' LEU . 4.4 mm? -63.82 -44.34 93.54 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.312 -0.404 . . . . 74.52 110.955 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -58.85 -27.47 61.94 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.698 -0.763 . . . . 62.43 112.552 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 198' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 -67.38 -43.79 80.52 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.778 0.323 . . . . 75.21 110.909 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.15 -26.33 64.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.232 -0.44 . . . . 73.13 110.855 -179.794 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -83.98 2.96 36.38 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.138 -0.483 . . . . 75.12 110.926 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 83.52 -8.04 66.55 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.759 -0.734 . . . . 50.41 112.469 179.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 202' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -49.84 134.84 20.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.833 0.349 . . . . 71.04 110.85 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -102.66 159.1 17.72 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.727 -0.749 . . . . 64.44 112.468 -179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 29.2 m-70 -58.7 158.26 8.21 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.786 0.327 . . . . 74.32 110.899 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -124.09 138.97 54.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.253 -0.43 . . . . 72.42 110.939 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 3.1 p -76.79 -4.46 43.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.131 -0.486 . . . . 72.22 110.829 -179.742 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.71 135.09 83.58 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.624 0.726 . . . . 65.11 110.899 179.904 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.72 -6.3 18.26 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.709 2.273 . . . . 74.53 112.328 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -123.1 22.89 9.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.222 -0.444 . . . . 63.52 110.942 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 210' ' ' ALA . . . . . 0.479 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.13 145.63 26.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.15 -0.477 . . . . 64.4 111.144 179.851 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -69.56 -28.05 36.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.261 -0.427 . . . . 75.23 111.06 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 8.5 mmm -95.4 12.91 27.59 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.197 -0.456 . . . . 75.22 110.871 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 213' ' ' TYR . . . . . 0.418 ' CE2' ' HB ' ' A' ' 215' ' ' THR . 1.9 t80 -54.88 112.29 3.9 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-O 121.672 0.748 . . . . 73.43 110.898 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.82 -17.62 37.18 Favored 'Trans proline' 0 C--O 1.233 0.234 0 C-N-CA 122.698 2.266 . . . . 63.01 112.285 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 215' ' ' THR . . . . . 0.418 ' HB ' ' CE2' ' A' ' 213' ' ' TYR . 0.2 OUTLIER -83.48 59.53 5.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.29 -0.414 . . . . 74.24 111.127 -179.956 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -49.93 122.7 6.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.223 -0.444 . . . . 74.42 110.861 -179.906 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . 137.23 95.1 0.38 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.718 -0.754 . . . . 74.22 112.431 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 1.4 t30 179.71 -168.48 0.1 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.843 0.354 . . . . 64.22 110.877 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . -50.31 107.39 0.34 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.719 -0.753 . . . . 73.55 112.515 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 220' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -75.22 113.88 29.87 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.54 0.686 . . . . 73.41 110.916 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 150.42 68.33 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.654 2.236 . . . . 74.21 112.364 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.39 -31.21 33.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.217 -0.447 . . . . 75.43 110.977 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -124.5 -28.18 3.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.128 -0.487 . . . . 70.33 110.891 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER 67.04 141.3 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.16 -0.473 . . . . 71.11 110.823 179.97 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.92 163.43 32.82 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.08 -0.509 . . . . 65.02 110.851 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 11.5 mt -60.75 148.98 37.06 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.199 -0.455 . . . . 62.53 110.951 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 227' ' ' SER . . . . . 0.479 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 1.2 t -87.51 151.89 22.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.231 -0.441 . . . . 74.21 110.804 -179.882 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 19.7 tt0 -62.34 -66.07 0.59 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.146 -0.479 . . . . 74.54 110.809 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -55.55 -26.19 41.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.191 -0.459 . . . . 74.2 110.885 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -69.15 -48.12 63.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.179 -0.464 . . . . 74.23 110.867 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 231' ' ' ILE . . . . . . . . . . . . . 7.9 mt -68.3 -43.21 84.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.197 -0.456 . . . . 73.41 111.059 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 2.0 pttp -62.84 -31.85 72.95 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.232 -0.44 . . . . 73.32 110.915 179.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -62.62 -49.95 68.68 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.813 -0.708 . . . . 65.45 112.473 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 234' ' ' ILE . . . . . 0.423 ' CG1' ' CD1' ' A' ' 238' ' ' TYR . 6.7 tt -73.07 -30.83 32.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.865 0.364 . . . . 74.41 111.174 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -68.67 -24.03 64.47 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.123 -0.489 . . . . 71.13 110.977 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 236' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.76 -28.17 60.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.126 -0.488 . . . . 74.41 110.915 179.911 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 237' ' ' LEU . . . . . 0.418 ' CD2' ' HD2' ' A' ' 83' ' ' LYS . 10.3 tt -98.02 -29.36 13.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.149 -0.478 . . . . 75.41 110.889 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 238' ' ' TYR . . . . . 0.423 ' CD1' ' CG1' ' A' ' 234' ' ' ILE . 27.9 m-85 -91.99 -35.46 13.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.245 -0.434 . . . . 54.42 110.916 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -134.24 -119.92 2.02 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.784 -0.722 . . . . 72.22 112.479 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 3.6 ttpp -125.06 121.04 33.19 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.812 0.339 . . . . 75.42 110.952 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 1.5 tpt180 179.91 178.37 0.59 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 73.34 110.886 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 1.4 p 52.9 -171.07 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.175 -0.466 . . . . 62.43 110.868 -179.803 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 9.2 p-10 -165.87 -40.89 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.148 -0.478 . . . . 72.13 110.902 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 14.8 p -139.54 -173.52 3.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.208 -0.451 . . . . 71.41 110.859 -179.829 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 1.3 ptm180 -69.26 153.23 43.98 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.185 -0.462 . . . . 75.43 110.891 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -173.23 -45.57 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 72.11 110.875 179.942 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 116.284 -0.417 . . . . 74.13 110.901 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 302' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' -2' ' ' LEU . . . . . . . . . . . . . 16.8 tp . . . . . 0 C--O 1.232 0.153 0 CA-C-O 121.68 0.752 . . . . 73.02 110.953 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' -1' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.71 177.66 5.32 Favored 'Trans proline' 0 C--O 1.233 0.235 0 C-N-CA 122.718 2.279 . . . . 73.21 112.352 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 2.2 mt -133.94 73.36 71.07 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-O 121.687 0.756 . . . . 75.23 110.951 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.68 -173.67 0.75 Allowed 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.731 2.287 . . . . 64.24 112.373 179.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 -86.09 99.78 11.72 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.246 -0.434 . . . . 62.24 110.902 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -95.27 -25.52 16.31 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.225 -0.443 . . . . 74.01 110.876 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.53 -34.08 66.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.184 -0.462 . . . . 71.4 111.085 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -55.91 -24.81 43.29 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.755 -0.736 . . . . 62.21 112.541 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -108.79 20.57 29.13 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.759 -0.734 . . . . 54.42 112.481 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 3.0 mtp -97.76 162.82 13.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.8 0.334 . . . . 72.23 110.844 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -112.77 168.49 9.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.282 -0.417 . . . . 73.24 110.887 -179.804 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -55.63 -32.08 62.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.201 -0.454 . . . . 73.44 110.852 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -63.48 -42.77 98.55 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.211 -0.45 . . . . 72.33 110.944 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.8 -42.91 99.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.162 -0.472 . . . . 72.14 110.896 179.894 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 19.4 t-105 -73.04 -32.98 65.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.166 -0.47 . . . . 71.22 110.886 -179.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -72.26 -42.2 65.89 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.19 -0.459 . . . . 72.51 110.892 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -63.54 -36.85 85.15 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.156 -0.475 . . . . 74.32 110.944 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.19 -34.85 68.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.113 -0.494 . . . . 74.22 111.104 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -69.88 -37.83 76.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.242 -0.435 . . . . 73.12 110.987 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -77.47 -31.56 53.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.179 -0.464 . . . . 72.4 110.811 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 4.0 m-30 -59.79 -36.09 75.99 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.212 -0.449 . . . . 75.11 110.897 -179.794 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -72.11 -21.01 61.54 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.146 -0.479 . . . . 75.43 110.876 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.4 ptmt -77.62 -26.56 50.65 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.219 -0.446 . . . . 75.45 110.901 179.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.43 ' HG3' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -83.83 -27.85 28.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.444 . . . . 74.22 110.871 -179.989 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.43 ' N ' ' HG3' ' A' ' 21' ' ' ARG . 2.7 m-85 -60.79 -22.36 64.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.196 -0.456 . . . . 75.2 110.868 -179.898 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -120.38 48.14 1.64 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.206 -0.452 . . . . 74.4 110.899 -179.845 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.1 mt 70.68 -72.01 0.12 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.114 -0.494 . . . . 75.43 110.926 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -177.78 103.87 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.233 -0.44 . . . . 71.41 110.932 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -102.79 94.8 5.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.137 -0.483 . . . . 74.25 110.862 179.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -85.12 -20.6 30.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.138 -0.483 . . . . 62.15 110.832 -179.778 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.24 -11.26 60.65 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.18 -0.464 . . . . 74.51 110.924 -179.98 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.6 m -86.13 9.73 16.53 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.085 -0.507 . . . . 72.53 111.137 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 14.4 ptmt -45.05 157.24 0.08 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.239 -0.437 . . . . 74.12 110.894 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 5.2 t30 67.31 127.4 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.208 -0.451 . . . . 74.52 110.869 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -50.48 -31.67 15.98 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.109 -0.496 . . . . 71.02 111.053 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -54.39 -34.45 61.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.226 -0.443 . . . . 71.33 110.883 -179.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 46.2 m -85.59 -30.23 23.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.166 -0.47 . . . . 74.02 110.858 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.51 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 1.8 mm? -58.04 -36.3 72.54 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.108 -0.496 . . . . 74.54 110.922 179.919 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.64 -50.87 71.73 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.211 -0.449 . . . . 73.13 110.943 179.858 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.56 -36.76 84.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.122 -0.49 . . . . 71.12 111.103 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.49 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.7 OUTLIER -68.66 -49.75 56.62 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.181 -0.463 . . . . 74.43 110.865 -179.995 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 35' ' ' LEU . 7.0 mt -56.44 -36.89 69.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.28 -0.418 . . . . 74.44 110.919 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.9 mttt -58.52 -45.56 88.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.146 -0.479 . . . . 74.2 110.878 179.856 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.49 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 2.3 pt-20 -60.43 -32.58 71.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.254 -0.43 . . . . 75.11 110.919 179.931 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.3 tmt? -68.25 -34.36 76.05 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.12 -0.491 . . . . 63.43 110.914 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.452 ' HG2' ' O ' ' A' ' 39' ' ' LEU . 6.8 mm-40 -57.14 -39.64 75.6 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.265 -0.425 . . . . 75.32 110.952 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.4 mmpt? -69.9 -28.27 65.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.137 -0.483 . . . . 75.11 110.947 179.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 43.6 t80 -70.37 -37.56 74.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.175 -0.466 . . . . 73.32 110.895 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -81.84 -35.04 29.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.158 -0.474 . . . . 70.43 110.898 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 106.06 -10.27 43.84 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.804 -0.712 . . . . 64.42 112.478 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.68 139.11 96.91 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.603 0.716 . . . . 74.31 110.931 -179.937 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.72 -51.98 0.36 Allowed 'Trans proline' 0 C--O 1.232 0.22 0 C-N-CA 122.67 2.246 . . . . 74.5 112.329 179.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -53.01 108.15 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.223 -0.444 . . . . 72.24 111.133 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.426 ' HA ' ' HG3' ' A' ' 43' ' ' GLN . 3.7 t -119.75 155.96 31.47 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.178 -0.465 . . . . 73.25 111.109 179.984 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.54 -7.58 57.39 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.774 -0.727 . . . . 64.24 112.435 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 15.3 mtt -135.1 161.17 36.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.789 0.328 . . . . 75.23 110.853 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.407 ' HA ' ' HB ' ' A' ' 58' ' ' VAL . 2.8 pp -156.59 128.97 7.53 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.169 -0.469 . . . . 74.32 110.941 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 176.2 -30.31 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 61.31 110.852 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 20.4 p -93.51 -88.48 0.23 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.218 -0.446 . . . . 75.25 110.821 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 2.9 mmm180 -84.71 -35.55 22.44 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.131 -0.486 . . . . 74.13 110.832 -179.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.407 ' HB ' ' HA ' ' A' ' 54' ' ' LEU . 16.6 t -60.64 -43.71 95.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.169 -0.469 . . . . 72.2 111.122 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -74.82 -31.25 25.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.244 -0.434 . . . . 75.2 111.155 179.951 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -67.17 -44.13 80.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.132 -0.485 . . . . 73.45 110.982 179.87 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 37.3 pt -66.89 -30.06 48.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.184 -0.462 . . . . 74.52 111.107 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -58.47 -40.67 83.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.181 -0.463 . . . . 74.01 110.893 179.888 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 16.0 pt20 -91.66 -23.94 19.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.29 -0.414 . . . . 45.15 110.905 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 4.2 ttmm -78.8 114.43 43.79 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.549 0.69 . . . . 75.32 110.906 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.85 140.22 41.82 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.668 2.246 . . . . 72.11 112.268 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -140.78 -61.69 0.49 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.157 -0.474 . . . . 73.22 110.873 -179.961 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -145.46 151.17 37.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.157 -0.474 . . . . 72.31 110.848 -179.93 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.545 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -109.51 24.27 20.46 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.677 -0.773 . . . . 64.23 112.437 -179.943 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -103.17 137.51 19.28 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.527 0.68 . . . . 74.23 111.177 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.69 141.92 46.84 Favored 'Trans proline' 0 N--CA 1.465 -0.152 0 C-N-CA 122.721 2.281 . . . . 63.44 112.33 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -94.78 22.67 6.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.47 . . . . 74.45 110.908 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -125.62 129.16 72.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.141 -0.481 . . . . 73.52 111.092 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -131.1 170.58 14.34 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.186 -0.461 . . . . 73.13 111.103 179.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -179.88 164.95 1.23 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.183 -0.462 . . . . 74.13 110.83 -179.986 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 7.0 p90 -50.44 97.1 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.165 -0.471 . . . . 71.51 110.879 -179.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 58.4 m -163.98 179.72 6.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.198 -0.455 . . . . 74.2 110.838 -179.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.66 ' O ' ' CB ' ' A' ' 78' ' ' PHE . 9.5 mt 74.29 -53.33 0.68 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.144 -0.48 . . . . 70.34 110.981 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . 0.66 ' CB ' ' O ' ' A' ' 77' ' ' LEU . 1.6 m-30 147.31 -59.21 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.256 0 CA-C-O 121.705 0.764 . . . . 71.24 110.89 179.938 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.498 ' HD2' ' N ' ' A' ' 78' ' ' PHE . 53.0 Cg_endo -69.77 -174.96 1.01 Allowed 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.636 2.224 . . . . 73.34 112.338 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -176.52 97.1 0.05 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.277 -0.419 . . . . 74.43 110.91 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.7 p -167.14 155.76 9.15 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-O 121.648 0.737 . . . . 70.4 110.838 -179.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 -49.27 0.58 Allowed 'Trans proline' 0 C--O 1.231 0.175 0 C-N-CA 122.708 2.272 . . . . 72.25 112.302 -179.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.38 -172.18 2.83 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.182 -0.463 . . . . 72.53 110.909 179.931 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . 0.419 ' CE2' ' HB3' ' A' ' 162' ' ' PRO . 61.0 m95 -64.68 140.32 58.86 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.255 -0.43 . . . . 73.31 110.915 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.15 -2.29 12.78 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.236 -0.438 . . . . 71.34 111.184 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.6 m -72.52 -178.87 2.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.134 -0.485 . . . . 73.12 110.872 -179.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.92 -15.98 18.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.121 -0.49 . . . . 71.12 110.882 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -155.67 143.37 11.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.243 -0.435 . . . . 74.14 111.176 179.871 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 6.5 t -118.92 130.26 73.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.2 -0.455 . . . . 72.25 111.132 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 21.9 p -119.88 165.92 13.98 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.161 -0.472 . . . . 75.51 111.149 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 3.1 p90 -151.45 146.48 25.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.211 -0.449 . . . . 70.51 110.901 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 4.0 ttt180 -149.17 131.68 15.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.142 -0.481 . . . . 74.3 110.852 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.439 HD12 ' HA ' ' A' ' 106' ' ' ASP . 5.0 mp -75.27 132.87 32.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.132 -0.485 . . . . 72.4 111.162 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.428 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 22.0 t -84.99 -40.29 14.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.166 -0.47 . . . . 74.41 111.111 179.897 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 84.5 p -159.15 169.41 24.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.15 -0.477 . . . . 64.24 110.889 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 12.6 p90 -123.61 155.15 38.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.126 -0.488 . . . . 74.1 110.932 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 5.3 t -94.12 141.19 28.83 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.144 -0.48 . . . . 75.33 111.16 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.7 -18.7 1.94 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.236 -0.438 . . . . 72.14 110.894 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.25 -36.93 85.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.169 -0.468 . . . . 74.13 110.818 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.2 mt -140.15 153.47 69.16 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.54 0.686 . . . . 72.52 110.952 179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . 0.419 ' HB2' HG21 ' A' ' 103' ' ' ILE . 53.4 Cg_endo -69.81 150.98 68.63 Favored 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.629 2.219 . . . . 73.11 112.324 179.887 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 12.7 t-160 -52.22 -27.89 16.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.164 -0.471 . . . . 74.11 110.919 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.419 HG21 ' HB2' ' A' ' 101' ' ' PRO . 0.0 OUTLIER -75.03 -39.17 43.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.218 -0.446 . . . . 74.02 111.126 -179.992 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 3.0 m -69.66 -39.11 77.25 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.157 -0.474 . . . . 54.24 111.14 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 76.5 t -72.83 -46.22 53.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.187 -0.461 . . . . 73.13 111.11 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.614 ' O ' HG23 ' A' ' 109' ' ' VAL . 0.3 OUTLIER -60.74 -44.17 97.01 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.147 -0.479 . . . . 63.44 110.814 179.987 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 11.2 ptm180 -70.16 -34.11 72.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.198 -0.456 . . . . 75.02 110.838 -179.856 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.57 ' HB3' ' HD2' ' A' ' 188' ' ' PHE . 0.0 OUTLIER -61.15 -48.26 82.4 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.17 -0.468 . . . . 75.05 110.877 -179.968 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.614 HG23 ' O ' ' A' ' 106' ' ' ASP . 1.5 m -55.4 -41.61 63.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.244 -0.435 . . . . 72.31 111.087 179.846 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.469 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 10.7 t -70.11 -33.51 71.93 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.16 -0.473 . . . . 72.14 110.878 -179.847 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -61.47 -32.86 72.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.105 -0.498 . . . . 74.35 110.957 179.931 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -97.14 -40.47 8.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.196 -0.457 . . . . 74.32 111.144 179.783 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.427 ' HB2' ' HG ' ' A' ' 196' ' ' LEU . 0.4 OUTLIER -65.38 -33.88 77.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.206 -0.452 . . . . 74.11 110.956 -180.0 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 36.7 t-20 -67.55 -35.71 79.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.177 -0.465 . . . . 75.15 110.812 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' MET . . . . . 0.44 ' HB3' ' CD2' ' A' ' 226' ' ' LEU . 0.0 OUTLIER -68.25 -33.6 74.67 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.226 -0.443 . . . . 74.0 110.89 179.888 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 6.0 m95 -68.55 -44.91 73.51 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.225 -0.443 . . . . 75.23 110.966 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -73.38 -40.43 48.45 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.695 -0.764 . . . . 73.44 112.532 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 4.5 ptpt -60.76 -16.93 45.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.709 0.29 . . . . 74.42 110.897 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 27.9 mm-40 -98.26 13.51 31.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.205 -0.452 . . . . 75.55 110.902 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.402 ' C ' ' H ' ' A' ' 122' ' ' LEU . 6.1 pt -147.64 150.31 36.31 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.561 0.696 . . . . 71.34 111.162 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.85 6.75 1.22 Allowed 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.662 2.242 . . . . 75.35 112.326 179.901 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.457 ' HB3' ' H ' ' A' ' 123' ' ' HIS . 10.2 mt -60.2 -160.37 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.259 -0.428 . . . . 73.22 110.882 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.457 ' H ' ' HB3' ' A' ' 122' ' ' LEU . 3.4 t-160 -154.31 121.29 5.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.199 -0.455 . . . . 74.12 110.848 179.836 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 10.0 m-30 -109.33 148.74 30.55 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.173 -0.467 . . . . 75.54 110.899 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -130.69 141.73 50.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.146 -0.479 . . . . 75.14 110.827 -179.884 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.93 147.5 30.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.148 -0.478 . . . . 74.04 110.911 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 29.9 m -103.08 126.3 57.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.258 -0.428 . . . . 50.13 111.145 179.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -142.45 -10.3 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.12 -0.491 . . . . 74.43 111.17 179.854 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -154.87 109.17 2.96 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.132 -0.486 . . . . 73.32 110.905 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.68 -159.72 14.33 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.722 -0.752 . . . . 62.11 112.457 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.3 p -101.82 156.33 17.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.852 0.358 . . . . 71.11 111.11 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -111.61 165.26 12.17 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.176 -0.465 . . . . 72.32 111.053 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.06 -62.54 1.36 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.225 -0.443 . . . . 75.41 110.817 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 4.6 mp -88.68 122.53 40.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 71.04 111.167 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' MET . . . . . 0.428 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 14.3 mmm -100.58 125.79 46.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.149 -0.478 . . . . 72.43 110.829 179.882 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.407 ' HB ' HG13 ' A' ' 93' ' ' ILE . 0.9 OUTLIER -105.92 94.97 3.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.165 -0.47 . . . . 70.04 111.113 179.989 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -129.7 167.71 21.43 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.742 -0.742 . . . . 63.34 112.462 179.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 55.3 m-85 -105.1 145.47 30.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.849 0.357 . . . . 74.01 110.913 -179.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . 169.72 166.11 0.05 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.12 -0.491 . . . . 71.21 111.102 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.414 ' HB2' ' HB3' ' A' ' 149' ' ' PHE . 0.0 OUTLIER -107.94 174.21 5.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.262 -0.426 . . . . 72.34 110.819 -179.926 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . 0.481 ' H ' ' HA ' ' A' ' 149' ' ' PHE . . . -55.67 -16.44 11.44 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.753 -0.737 . . . . 74.24 112.471 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -94.12 13.12 24.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.828 0.347 . . . . 75.03 111.113 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 3.2 p80 -79.42 -4.48 51.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.202 -0.453 . . . . 73.45 110.867 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 110.77 48.13 0.75 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.69 -0.767 . . . . 60.43 112.46 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -161.79 175.11 12.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.9 0.381 . . . . 72.14 110.818 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 69.9 p -63.81 175.22 1.19 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.154 -0.476 . . . . 64.54 110.862 -179.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 64.52 118.93 0.02 OUTLIER Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.743 0.782 . . . . 73.4 110.876 -179.882 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.72 151.18 69.26 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.654 2.236 . . . . 74.53 112.325 179.901 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 149' ' ' PHE . . . . . 0.492 ' O ' ' CG ' ' A' ' 150' ' ' ASP . 3.6 p90 -54.23 -38.38 65.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.231 -0.44 . . . . 70.0 110.844 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . 0.492 ' CG ' ' O ' ' A' ' 149' ' ' PHE . 2.7 p30 48.72 18.46 0.19 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.166 -0.47 . . . . 72.24 110.858 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . 0.42 ' C ' ' O ' ' A' ' 150' ' ' ASP . . . 36.44 -150.29 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.767 -0.73 . . . . 75.42 112.434 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.72 144.66 54.93 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.709 2.273 . . . . 75.11 112.289 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . 0.449 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 106.04 -138.14 14.18 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.737 -0.744 . . . . 70.32 112.447 179.904 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 154' ' ' ASN . . . . . 0.449 ' C ' ' O ' ' A' ' 153' ' ' GLY . 3.6 p30 -34.2 136.37 0.13 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.882 0.373 . . . . 74.45 110.881 -179.856 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 75.56 110.56 0.07 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.185 -0.461 . . . . 63.14 111.15 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . 0.475 HD11 HG13 ' A' ' 186' ' ' ILE . 0.4 OUTLIER -91.17 -54.32 3.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.222 -0.445 . . . . 75.02 110.896 -179.979 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . 0.545 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -163.85 148.95 10.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.22 -0.446 . . . . 73.44 111.022 179.794 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 14.5 p-80 -107.54 125.38 51.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.155 -0.475 . . . . 74.34 110.908 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -110.54 155.09 22.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.229 -0.441 . . . . 74.42 111.1 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 16.7 m-85 -106.86 151.95 24.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.246 -0.434 . . . . 75.31 110.867 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -78.52 164.75 54.29 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.626 0.727 . . . . 71.14 111.046 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 162' ' ' PRO . . . . . 0.419 ' HB3' ' CE2' ' A' ' 84' ' ' TRP . 53.2 Cg_endo -69.83 78.48 1.03 Allowed 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.688 2.259 . . . . 74.44 112.257 -179.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 163' ' ' GLY . . . . . 0.431 ' HA3' ' HG3' ' A' ' 79' ' ' PRO . . . -130.45 119.87 2.87 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.73 -0.748 . . . . 72.32 112.422 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 50.85 -169.86 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.874 0.369 . . . . 73.1 111.101 -179.896 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -75.51 -54.57 5.45 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.752 -0.737 . . . . 74.03 112.508 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 10.1 tt -54.36 -40.15 67.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.863 0.364 . . . . 75.02 110.895 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -80.22 164.04 47.47 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.742 -0.742 . . . . 43.43 112.512 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 84.54 23.11 51.88 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.815 -0.707 . . . . 74.31 112.515 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -91.3 163.52 14.19 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.736 0.303 . . . . 63.41 110.89 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.49 130.95 55.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.225 -0.443 . . . . 74.21 111.061 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 27.3 m170 -125.1 158.55 33.58 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 72.53 110.831 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 64.0 m-85 -142.26 137.37 30.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.251 -0.432 . . . . 71.44 110.904 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 55.2 t0 -69.08 99.23 1.07 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 74.11 110.82 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.58 -16.41 10.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.152 -0.476 . . . . 74.45 110.879 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -77.86 -16.32 58.37 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.163 -0.472 . . . . 73.32 110.783 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 23.6 mm-40 -83.38 -175.65 5.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.241 -0.436 . . . . 71.41 110.898 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 1.9 mtt180 -109.8 116.79 32.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.143 -0.481 . . . . 74.32 110.917 -179.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 51.0 m95 -116.61 141.18 48.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.253 -0.43 . . . . 74.32 110.919 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 2.0 t -177.61 164.36 2.02 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.19 -0.459 . . . . 74.13 111.129 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -124.59 -68.76 0.84 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.213 -0.449 . . . . 61.52 110.881 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -70.51 -10.88 67.54 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.712 -0.756 . . . . 62.41 112.501 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 182' ' ' SER . . . . . 0.483 ' O ' ' C ' ' A' ' 183' ' ' SER . 0.2 OUTLIER -97.01 -24.29 15.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.878 0.37 . . . . 74.0 110.84 -179.723 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 183' ' ' SER . . . . . 0.483 ' C ' ' O ' ' A' ' 182' ' ' SER . 7.4 p 31.84 71.56 0.08 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.172 -0.467 . . . . 64.12 110.854 -179.877 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -117.09 -32.64 4.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.215 -0.448 . . . . 74.43 110.895 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -132.28 -127.23 2.8 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.812 -0.708 . . . . 74.22 112.529 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 186' ' ' ILE . . . . . 0.475 HG13 HD11 ' A' ' 156' ' ' LEU . 6.7 mm -79.53 99.81 3.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.823 0.344 . . . . 73.22 111.147 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -55.96 125.65 22.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.173 -0.467 . . . . 71.31 110.824 179.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 188' ' ' PHE . . . . . 0.57 ' HD2' ' HB3' ' A' ' 108' ' ' LEU . 1.1 t80 -53.85 -33.28 55.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.185 -0.461 . . . . 75.45 110.863 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.21 -47.62 70.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.193 -0.458 . . . . 60.14 110.907 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 10.1 m-30 -69.98 -40.15 75.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.228 -0.442 . . . . 74.22 110.908 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -70.22 -35.8 74.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.119 -0.491 . . . . 61.32 111.061 179.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 192' ' ' ALA . . . . . 0.436 ' O ' ' CD2' ' A' ' 196' ' ' LEU . . . -56.93 -44.66 82.69 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.26 -0.427 . . . . 52.32 111.132 179.914 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.07 -41.51 83.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.207 -0.451 . . . . 72.43 111.164 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 5.0 t-160 -72.81 -41.73 64.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 71.44 110.844 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -71.56 -48.42 48.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.164 -0.471 . . . . 71.01 111.142 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 196' ' ' LEU . . . . . 0.489 HD22 ' N ' ' A' ' 196' ' ' LEU . 4.3 mm? -64.66 -42.02 95.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.232 -0.44 . . . . 74.52 110.885 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -60.11 -29.04 67.48 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.784 -0.722 . . . . 62.43 112.438 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 198' ' ' HIS . . . . . . . . . . . . . 6.1 m-70 -69.19 -33.95 74.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.876 0.37 . . . . 75.21 110.947 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -68.92 -21.37 64.22 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.179 -0.464 . . . . 73.13 110.818 -179.794 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -88.0 -1.05 57.75 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.155 -0.475 . . . . 75.12 110.913 -179.974 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 84.3 8.97 82.75 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.721 -0.752 . . . . 50.41 112.501 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 202' ' ' MET . . . . . . . . . . . . . 97.3 mmm -71.19 159.27 34.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.885 0.374 . . . . 71.04 110.882 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -125.94 159.18 20.34 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.682 -0.77 . . . . 64.44 112.45 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 16.4 m-70 -50.67 161.05 0.37 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.842 0.354 . . . . 74.32 110.873 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -123.16 150.47 43.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.199 -0.455 . . . . 72.42 110.915 -179.832 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -87.63 -4.67 58.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.154 -0.475 . . . . 72.22 110.864 -179.817 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.55 137.96 83.41 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 121.557 0.694 . . . . 65.11 110.859 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 -7.23 20.54 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.699 2.266 . . . . 74.53 112.317 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 -128.97 30.78 5.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.24 -0.436 . . . . 63.52 110.9 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -87.11 145.7 26.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.129 -0.487 . . . . 64.4 111.149 179.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -67.77 -27.72 39.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.231 -0.44 . . . . 75.23 111.109 -179.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 81.1 mtp -97.1 8.58 44.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.167 -0.47 . . . . 75.22 110.906 179.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 213' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -55.89 114.16 6.99 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.695 0.759 . . . . 73.43 110.913 -179.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -69.72 -17.95 37.49 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.658 2.239 . . . . 63.01 112.372 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -83.98 60.22 5.72 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.2 -0.454 . . . . 74.24 111.103 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -47.51 122.75 5.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.968 0.413 . . . . 74.42 110.939 -179.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -131.83 -163.44 10.78 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.795 -0.717 . . . . 74.22 112.53 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 5.5 p30 -98.68 -168.15 1.6 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.905 0.383 . . . . 64.22 110.867 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . 60.04 76.77 0.21 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.742 -0.742 . . . . 73.55 112.507 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 220' ' ' ASP . . . . . . . . . . . . . 7.1 p30 -120.28 153.95 56.02 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-O 121.61 0.719 . . . . 73.41 110.845 -179.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 221' ' ' PRO . . . . . 0.411 ' HG2' ' HB2' ' A' ' 224' ' ' PHE . 53.0 Cg_endo -69.81 168.77 20.66 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.721 2.281 . . . . 74.21 112.337 -179.929 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.09 -25.69 34.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.258 -0.428 . . . . 75.43 110.885 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 -109.56 -41.67 4.52 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.258 -0.428 . . . . 70.33 110.934 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 224' ' ' PHE . . . . . 0.411 ' HB2' ' HG2' ' A' ' 221' ' ' PRO . 8.1 t80 61.62 132.12 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.142 -0.481 . . . . 71.11 110.861 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.3 -176.87 5.2 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.137 -0.483 . . . . 65.02 110.84 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . 0.44 ' CD2' ' HB3' ' A' ' 115' ' ' MET . 0.7 OUTLIER -59.7 149.12 31.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.204 -0.453 . . . . 62.53 110.97 179.935 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 227' ' ' SER . . . . . . . . . . . . . 2.3 t -86.4 160.43 19.06 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.285 -0.416 . . . . 74.21 110.911 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -63.29 -64.94 0.76 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.134 -0.485 . . . . 74.54 110.925 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -55.58 -26.55 44.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.204 -0.453 . . . . 74.2 110.822 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.36 -48.63 60.69 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.314 -0.403 . . . . 74.23 110.865 -179.934 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 231' ' ' ILE . . . . . . . . . . . . . 7.6 mt -69.06 -42.92 82.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.243 -0.435 . . . . 73.41 111.168 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 232' ' ' LYS . . . . . 0.409 ' HG3' ' N ' ' A' ' 233' ' ' GLY . 0.0 OUTLIER -64.57 -32.13 73.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.167 -0.47 . . . . 73.32 110.919 179.826 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 233' ' ' GLY . . . . . 0.409 ' N ' ' HG3' ' A' ' 232' ' ' LYS . . . -63.1 -49.0 75.31 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.749 -0.738 . . . . 65.45 112.472 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 7.3 tt -72.97 -32.45 39.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.759 0.314 . . . . 74.41 111.11 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -70.12 -24.52 63.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.21 -0.45 . . . . 71.13 110.968 179.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 236' ' ' LYS . . . . . 0.418 ' HE2' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.32 -27.58 60.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.169 -0.469 . . . . 74.41 110.879 -179.991 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 237' ' ' LEU . . . . . 0.418 ' HB2' ' HE2' ' A' ' 236' ' ' LYS . 3.8 tt -97.78 -26.74 14.61 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.241 -0.436 . . . . 75.41 110.907 179.938 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 238' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -91.96 -35.2 14.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.194 -0.457 . . . . 54.42 110.985 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -142.85 -119.16 1.41 Allowed Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.794 -0.717 . . . . 72.22 112.499 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 31.8 tttm -87.9 149.74 23.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.749 0.309 . . . . 75.42 110.946 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 6.0 ptm180 -91.19 -173.59 3.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.215 -0.448 . . . . 73.34 110.903 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 40.3 t -146.75 -45.03 0.18 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.273 -0.421 . . . . 62.43 110.866 -179.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -164.55 -176.16 4.2 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.159 -0.473 . . . . 72.13 110.903 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -106.51 117.13 33.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.24 -0.437 . . . . 71.41 110.864 -179.844 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -172.86 -179.66 2.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.184 -0.462 . . . . 75.43 110.871 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 2.5 tttm 59.74 83.04 0.14 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.224 -0.443 . . . . 72.11 110.851 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.232 -0.44 . . . . 74.13 110.826 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 302' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' -2' ' ' LEU . . . . . . . . . . . . . 1.3 mp . . . . . 0 C--O 1.231 0.123 0 CA-C-O 121.618 0.723 . . . . 73.02 110.952 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' -1' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.8 176.4 6.85 Favored 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.713 2.275 . . . . 73.21 112.35 179.815 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.64 160.64 25.57 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.567 0.698 . . . . 75.23 110.92 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.75 -170.97 0.43 Allowed 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.713 2.275 . . . . 64.24 112.4 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -118.8 79.43 1.39 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.288 -0.414 . . . . 62.24 110.867 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -95.19 -23.48 17.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.247 -0.433 . . . . 74.01 110.901 -179.946 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.45 -33.85 66.28 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.149 -0.478 . . . . 71.4 111.158 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -56.15 -34.18 62.14 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.755 -0.736 . . . . 62.21 112.486 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -108.93 21.57 27.19 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.647 -0.787 . . . . 54.42 112.545 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.83 164.13 24.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.784 0.326 . . . . 72.23 110.876 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -83.1 168.69 16.64 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.459 . . . . 73.24 110.852 -179.777 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -58.84 -32.03 69.05 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.146 -0.479 . . . . 73.44 110.858 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -64.19 -42.8 96.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.156 -0.475 . . . . 72.33 110.979 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -68.53 -38.56 80.96 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.178 -0.465 . . . . 72.14 110.922 179.933 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 50.3 t-105 -73.06 -33.45 65.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 71.22 110.983 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -58.88 -35.62 73.29 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.202 -0.454 . . . . 72.51 110.884 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.09 -36.64 84.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.185 -0.461 . . . . 74.32 110.857 -179.863 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.1 -42.4 80.69 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.251 -0.432 . . . . 74.22 111.138 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.07 -43.03 62.41 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.187 -0.46 . . . . 73.12 110.927 -179.926 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -61.63 -32.44 72.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.243 -0.435 . . . . 72.4 110.938 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 8.5 m-85 -70.38 -37.07 74.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.15 -0.477 . . . . 75.11 110.953 -179.853 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -71.73 -24.54 61.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.108 -0.496 . . . . 75.43 110.869 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.43 ' HE2' ' HA ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -72.23 -42.36 65.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.238 -0.437 . . . . 75.45 110.918 179.801 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.43 ' HA ' ' HE2' ' A' ' 20' ' ' LYS . 3.2 ptm180 -67.93 -28.19 67.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.19 -0.459 . . . . 74.22 110.887 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.428 ' N ' ' HG3' ' A' ' 21' ' ' ARG . 2.0 m-85 -62.13 -25.09 67.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.199 -0.455 . . . . 75.2 110.86 -179.944 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -120.91 38.36 4.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.143 -0.48 . . . . 74.4 110.92 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.7 mt 70.95 -71.43 0.13 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.086 -0.506 . . . . 75.43 110.887 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -177.41 105.63 0.05 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.22 -0.445 . . . . 71.41 110.924 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -88.32 90.44 8.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.123 -0.49 . . . . 74.25 110.85 179.918 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 24.3 p -85.04 -36.21 21.4 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.151 -0.477 . . . . 62.15 110.917 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -69.9 -14.36 62.69 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.084 -0.507 . . . . 74.51 110.892 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.0 m -90.93 9.55 30.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.197 -0.456 . . . . 72.53 111.179 -179.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.6 108.69 1.02 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.165 -0.471 . . . . 74.12 110.849 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -179.61 153.19 0.54 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.235 -0.439 . . . . 74.52 110.895 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.28 -40.03 59.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.175 -0.466 . . . . 71.02 111.089 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 12.8 m120 -83.24 -25.42 31.68 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.254 -0.43 . . . . 71.33 110.89 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 83.7 p -58.48 -22.24 54.21 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.165 -0.47 . . . . 74.02 110.835 -179.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -57.89 -43.08 85.88 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.152 -0.476 . . . . 74.54 110.921 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.63 -53.12 56.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.195 -0.457 . . . . 73.13 110.843 179.944 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -59.35 -49.32 78.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.156 -0.475 . . . . 71.12 111.071 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 33.7 tttt -59.91 -38.79 83.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.225 -0.443 . . . . 74.43 110.92 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.53 -35.93 80.04 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.267 -0.424 . . . . 74.44 110.931 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 19.3 mttt -63.14 -45.17 93.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.123 -0.489 . . . . 74.2 110.951 179.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -69.48 -33.32 72.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.191 -0.458 . . . . 75.11 110.903 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.9 ttt -66.06 -47.66 73.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.137 -0.483 . . . . 63.43 110.922 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.613 ' HA ' ' CD1' ' A' ' 48' ' ' LEU . 17.4 mt-30 -58.64 -39.65 81.18 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.223 -0.444 . . . . 75.32 110.896 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.8 mmpt? -59.23 -20.57 55.19 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.248 -0.433 . . . . 75.11 110.823 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 68.8 t80 -70.42 -46.3 64.2 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.274 -0.421 . . . . 73.32 110.817 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.43 ' HB2' ' CD1' ' A' ' 48' ' ' LEU . 36.1 m-85 -81.82 -3.78 54.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.175 -0.466 . . . . 70.43 110.888 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.45 12.49 84.49 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.689 -0.767 . . . . 64.42 112.475 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.613 ' CD1' ' HA ' ' A' ' 43' ' ' GLN . 0.3 OUTLIER -59.73 140.58 89.45 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.568 0.699 . . . . 74.31 110.941 -179.936 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.8 -53.29 0.28 Allowed 'Trans proline' 0 C--O 1.231 0.159 0 C-N-CA 122.72 2.28 . . . . 74.5 112.318 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -53.33 139.25 11.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 72.24 111.032 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -129.63 126.94 39.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.133 -0.485 . . . . 73.25 111.174 179.877 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 85.07 5.69 85.62 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.735 -0.745 . . . . 64.24 112.509 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -135.05 154.63 51.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.829 0.347 . . . . 75.23 110.864 -179.942 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.8 pp -159.16 130.23 6.11 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.203 -0.453 . . . . 74.32 110.955 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 173.96 -24.38 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.132 -0.486 . . . . 61.31 110.898 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -104.09 -81.27 0.52 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 75.25 110.912 -179.888 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -84.3 -45.55 12.71 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.161 -0.472 . . . . 74.13 110.954 179.974 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.437 ' O ' HG12 ' A' ' 61' ' ' ILE . 41.3 t -57.14 -45.69 84.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.124 -0.489 . . . . 72.2 111.129 179.94 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -74.63 -30.45 25.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.163 -0.472 . . . . 75.2 111.105 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -59.62 -40.47 87.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.174 -0.466 . . . . 73.45 110.832 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.437 HG12 ' O ' ' A' ' 58' ' ' VAL . 0.5 OUTLIER -68.43 -29.43 44.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.156 -0.474 . . . . 74.52 111.115 -179.968 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 6.9 mtt -65.19 -32.68 74.48 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.161 -0.472 . . . . 74.01 110.932 179.775 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -100.66 -26.48 13.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.16 -0.473 . . . . 45.15 110.913 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.35 119.01 71.89 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.52 0.676 . . . . 75.32 110.932 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.71 143.36 50.83 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.706 2.271 . . . . 72.11 112.33 179.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 2.0 ppt_? -155.73 -53.73 0.09 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.192 -0.458 . . . . 73.22 110.882 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 6.4 t -139.42 123.88 18.23 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.163 -0.471 . . . . 72.31 110.928 -179.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.534 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -79.33 -36.91 25.81 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.747 -0.739 . . . . 64.23 112.462 -179.888 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 1.1 t -64.71 146.45 98.45 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-O 121.592 0.71 . . . . 74.23 111.209 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -69.81 159.85 51.84 Favored 'Trans proline' 0 C--O 1.231 0.166 0 C-N-CA 122.675 2.25 . . . . 63.44 112.302 -180.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -85.0 -0.29 53.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.219 -0.446 . . . . 74.45 110.876 179.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.9 m -103.56 128.56 56.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.199 -0.455 . . . . 73.52 111.095 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -131.13 170.64 14.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.176 -0.466 . . . . 73.13 111.108 179.825 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -130.47 134.64 47.25 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.204 -0.453 . . . . 74.13 110.921 -179.955 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 39.4 p90 -48.92 121.84 5.14 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.213 -0.448 . . . . 71.51 110.839 -179.789 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -56.42 179.1 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.101 -0.5 . . . . 74.2 110.829 -179.862 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -137.31 -61.95 0.63 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.136 -0.484 . . . . 70.34 110.911 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . 0.554 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 0.1 OUTLIER -75.08 -55.94 2.14 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.654 0.74 . . . . 71.24 110.926 179.914 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.554 ' HD2' ' N ' ' A' ' 78' ' ' PHE . 52.9 Cg_endo -69.78 114.94 3.87 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.714 2.276 . . . . 73.34 112.324 -179.974 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 8.0 m-20 -54.71 104.05 0.1 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.216 -0.447 . . . . 74.43 110.911 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 65.03 160.15 0.12 Allowed Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.654 0.74 . . . . 70.4 110.871 -179.839 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 -23.08 31.12 Favored 'Trans proline' 0 C--O 1.232 0.195 0 C-N-CA 122.688 2.259 . . . . 72.25 112.316 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 4.2 mtpt -88.98 150.72 22.68 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.229 -0.441 . . . . 72.53 110.906 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . 0.477 ' N ' ' HH ' ' A' ' 238' ' ' TYR . 95.6 m95 -50.96 132.54 27.24 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.324 -0.398 . . . . 73.31 110.935 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -114.48 -10.66 12.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.307 -0.406 . . . . 71.34 111.147 -179.916 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -64.85 -176.77 0.29 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.241 -0.436 . . . . 73.12 110.909 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 9.7 mptt -99.39 -11.14 21.43 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.116 -0.493 . . . . 71.12 110.885 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -156.19 142.1 10.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.172 -0.467 . . . . 74.14 111.141 179.877 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 90.5 t -118.46 130.51 73.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.101 -0.499 . . . . 72.25 111.156 179.865 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -115.95 161.57 18.64 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.202 -0.453 . . . . 75.51 111.128 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 4.6 p90 -149.37 147.16 27.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 70.51 110.88 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -150.07 138.86 20.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.103 -0.498 . . . . 74.3 110.96 -179.946 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.0 mm -78.29 133.48 30.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.24 -0.436 . . . . 72.4 111.169 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.481 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 18.8 t -86.91 -40.47 14.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.194 -0.457 . . . . 74.41 111.201 179.825 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 2.9 t -143.67 169.38 17.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.128 -0.487 . . . . 64.24 110.859 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 8.8 p90 -111.62 148.88 32.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.165 -0.47 . . . . 74.1 110.926 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' THR . . . . . 0.468 ' O ' ' O ' ' A' ' 100' ' ' LEU . 0.2 OUTLIER -82.91 141.05 32.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.071 -0.513 . . . . 75.33 111.134 -179.986 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 2.8 ppt_? -71.7 -8.76 56.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.209 -0.45 . . . . 72.14 110.799 -179.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -96.6 -25.79 15.47 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.199 -0.455 . . . . 74.13 110.876 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.468 ' O ' ' O ' ' A' ' 97' ' ' THR . 1.1 mp -137.68 152.45 72.68 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.618 0.723 . . . . 72.52 110.927 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . 0.401 ' HB2' HG21 ' A' ' 103' ' ' ILE . 53.9 Cg_endo -69.73 150.95 69.1 Favored 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 122.701 2.268 . . . . 73.11 112.309 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 4.7 t-160 -52.06 -25.59 9.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.455 . . . . 74.11 110.837 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.401 HG21 ' HB2' ' A' ' 101' ' ' PRO . 11.7 tt -77.26 -37.47 25.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.263 -0.426 . . . . 74.02 111.143 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 3.4 m -68.94 -39.19 79.71 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.174 -0.467 . . . . 54.24 111.13 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 81.1 t -71.76 -45.74 64.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.212 -0.449 . . . . 73.13 111.145 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.592 ' O ' HG23 ' A' ' 109' ' ' VAL . 16.0 t0 -62.61 -39.53 94.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.208 -0.451 . . . . 63.44 110.917 179.927 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . 0.513 ' HG3' ' N ' ' A' ' 108' ' ' LEU . 0.0 OUTLIER -70.57 -33.8 71.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.168 -0.469 . . . . 75.02 110.926 179.996 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.513 ' N ' ' HG3' ' A' ' 107' ' ' ARG . 0.0 OUTLIER -65.61 -49.56 68.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.202 -0.453 . . . . 75.05 110.934 -179.971 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.592 HG23 ' O ' ' A' ' 106' ' ' ASP . 1.6 m -55.83 -42.93 72.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.183 -0.462 . . . . 72.31 111.059 179.877 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.489 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 44.6 t -70.2 -34.17 72.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.13 -0.487 . . . . 72.14 110.903 -179.824 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.16 -33.25 74.16 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.105 -0.498 . . . . 74.35 110.942 179.878 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.43 -40.28 9.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.272 -0.422 . . . . 74.32 111.16 179.755 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.435 HD13 HD13 ' A' ' 196' ' ' LEU . 0.4 OUTLIER -65.59 -33.2 75.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 74.11 110.949 179.97 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -69.59 -44.42 70.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.15 -0.477 . . . . 75.15 110.87 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.84 -34.86 70.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.207 -0.452 . . . . 74.0 110.843 179.936 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 5.1 m95 -62.53 -47.44 83.91 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.287 -0.415 . . . . 75.23 110.91 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . 0.481 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -72.97 -32.77 60.41 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.745 -0.741 . . . . 73.44 112.507 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.0 mmpt? -62.98 -14.3 45.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.842 0.353 . . . . 74.42 110.971 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.413 ' HG2' HG12 ' A' ' 231' ' ' ILE . 0.9 OUTLIER -104.65 13.71 31.07 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.112 -0.495 . . . . 75.55 110.906 179.904 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.481 ' CG1' ' HA2' ' A' ' 117' ' ' GLY . 5.8 pt -146.91 156.29 47.61 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.707 0.765 . . . . 71.34 111.063 -179.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.83 2.14 3.84 Favored 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 122.701 2.267 . . . . 75.35 112.333 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 7.1 mt -60.96 -157.42 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.219 -0.446 . . . . 73.22 110.892 179.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 5.0 t60 -163.63 138.47 6.15 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.158 -0.474 . . . . 74.12 110.822 179.818 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 37.3 m-85 -120.88 148.83 43.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.195 -0.457 . . . . 75.54 110.902 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.4 141.22 51.48 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.204 -0.453 . . . . 75.14 110.877 -179.879 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.51 140.04 36.07 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.219 -0.446 . . . . 74.04 110.84 179.973 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 15.0 m -102.56 131.48 50.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.188 -0.46 . . . . 50.13 111.149 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -143.93 -22.33 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 74.43 111.122 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -138.6 109.19 6.58 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.151 -0.477 . . . . 73.32 110.91 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.67 -159.59 14.4 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.655 -0.783 . . . . 62.11 112.49 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.87 155.71 17.98 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.788 0.327 . . . . 71.11 111.115 -179.86 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -112.08 165.19 12.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.209 -0.45 . . . . 72.32 111.128 179.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -65.89 -62.61 1.4 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.23 -0.441 . . . . 75.41 110.888 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 53.6 mt -86.59 132.25 32.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.21 -0.45 . . . . 71.04 111.142 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' MET . . . . . 0.481 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 18.4 mmm -110.64 123.1 49.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.214 -0.448 . . . . 72.43 110.892 179.846 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -106.54 92.87 2.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.256 -0.429 . . . . 70.04 111.133 179.983 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . 0.427 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -135.56 162.58 24.91 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.783 -0.722 . . . . 63.34 112.491 179.911 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -105.25 142.53 34.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.856 0.36 . . . . 74.01 110.918 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . 179.74 168.02 1.18 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.199 -0.455 . . . . 71.21 111.107 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 38.3 mtm180 -103.29 173.43 6.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.226 -0.443 . . . . 72.34 110.899 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -52.8 -19.06 6.31 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.755 -0.736 . . . . 74.24 112.495 -179.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -87.89 13.36 10.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.857 0.36 . . . . 75.03 111.127 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 11.0 p80 -77.05 -22.02 53.59 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.17 -0.468 . . . . 73.45 110.823 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 138.18 52.67 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.798 -0.715 . . . . 60.43 112.509 -179.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 34.4 p-10 -173.36 156.59 3.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.885 0.374 . . . . 72.14 110.815 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 9.7 m -71.69 173.48 8.07 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.124 -0.489 . . . . 64.54 110.859 -179.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 147' ' ' TYR . . . . . 0.405 ' HA ' ' HD2' ' A' ' 148' ' ' PRO . 0.1 OUTLIER 63.1 106.82 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.571 0.7 . . . . 73.4 110.902 -179.887 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . 0.405 ' HD2' ' HA ' ' A' ' 147' ' ' TYR . 54.4 Cg_endo -69.71 143.54 51.41 Favored 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.717 2.278 . . . . 74.53 112.353 179.887 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 149' ' ' PHE . . . . . 0.449 ' CE1' ' HB2' ' A' ' 173' ' ' ASP . 0.1 OUTLIER -64.2 -14.7 57.03 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.247 -0.433 . . . . 70.0 110.931 179.943 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 75.6 -4.11 2.44 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.127 -0.488 . . . . 72.24 110.85 179.934 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 66.92 -137.96 34.48 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.711 -0.757 . . . . 75.42 112.515 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.72 141.33 45.08 Favored 'Trans proline' 0 C--O 1.231 0.144 0 C-N-CA 122.699 2.266 . . . . 75.11 112.37 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 103.4 -144.9 16.07 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.778 -0.725 . . . . 70.32 112.456 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -39.01 150.19 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.967 0.413 . . . . 74.45 110.88 -179.834 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 75.24 103.71 0.07 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.163 -0.471 . . . . 63.14 111.129 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . 0.45 HD12 HG13 ' A' ' 186' ' ' ILE . 0.5 OUTLIER -87.08 -54.98 4.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.224 -0.444 . . . . 75.02 110.96 179.911 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . 0.534 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -162.11 148.47 13.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.471 . . . . 73.44 111.045 179.76 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 32.0 p-80 -112.28 118.74 36.11 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.143 -0.48 . . . . 74.34 110.821 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -111.16 150.18 29.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 74.42 111.098 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -120.65 172.83 7.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.183 -0.462 . . . . 75.31 110.904 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -104.12 164.26 15.67 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.591 0.71 . . . . 71.14 111.133 179.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.8 88.49 0.54 Allowed 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.68 2.254 . . . . 74.44 112.38 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 163' ' ' GLY . . . . . 0.419 ' HA2' ' HG3' ' A' ' 79' ' ' PRO . . . -124.27 120.44 4.07 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.798 -0.715 . . . . 72.32 112.53 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 2.3 m 73.41 -68.33 0.23 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.823 0.344 . . . . 73.1 111.175 -179.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . 176.46 -61.67 0.1 Allowed Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.714 -0.755 . . . . 74.03 112.442 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 9.7 tt -53.95 -30.99 49.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.854 0.359 . . . . 75.02 110.897 -179.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -72.43 -173.87 22.97 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.765 -0.731 . . . . 43.43 112.465 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 73.01 22.93 78.75 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.69 -0.767 . . . . 74.31 112.498 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -100.44 161.6 13.49 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.859 0.362 . . . . 63.41 110.882 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.56 130.76 55.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.204 -0.453 . . . . 74.21 111.024 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 48.3 m170 -127.0 132.74 50.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.181 -0.463 . . . . 72.53 110.862 -180.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 38.0 m-85 -116.13 138.86 50.88 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.238 -0.437 . . . . 71.44 110.883 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 173' ' ' ASP . . . . . 0.449 ' HB2' ' CE1' ' A' ' 149' ' ' PHE . 11.1 t0 -64.92 95.19 0.15 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 74.11 110.858 179.983 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 2.9 pp20? -55.64 -18.7 8.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.23 -0.441 . . . . 74.45 110.904 -179.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.82 -22.73 42.68 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.177 -0.465 . . . . 73.32 110.884 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 176' ' ' GLU . . . . . 0.402 ' HG3' HD13 ' A' ' 156' ' ' LEU . 0.0 OUTLIER -72.73 -170.99 0.76 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 71.41 110.89 -179.926 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -116.57 114.37 24.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.166 -0.47 . . . . 74.32 110.909 -179.88 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 48.6 m95 -116.77 142.77 46.49 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.173 -0.467 . . . . 74.32 111.014 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 13.1 t -177.66 163.57 1.91 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.279 -0.419 . . . . 74.13 111.183 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -125.0 -68.86 0.82 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.22 -0.445 . . . . 61.52 110.913 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -63.6 -13.13 49.79 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.736 -0.745 . . . . 62.41 112.555 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 182' ' ' SER . . . . . 0.402 ' O ' ' C ' ' A' ' 183' ' ' SER . 0.3 OUTLIER -93.48 -24.39 18.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.917 0.389 . . . . 74.0 110.877 -179.8 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 183' ' ' SER . . . . . 0.402 ' C ' ' O ' ' A' ' 182' ' ' SER . 7.4 p 37.97 43.78 0.56 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.091 -0.504 . . . . 64.12 110.854 -179.809 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 1.2 tt -107.51 -33.39 7.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.104 -0.498 . . . . 74.43 110.91 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -113.42 -145.58 9.3 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.736 -0.745 . . . . 74.22 112.485 179.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 186' ' ' ILE . . . . . 0.45 HG13 HD12 ' A' ' 156' ' ' LEU . 8.2 mm -79.03 99.54 3.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.893 0.377 . . . . 73.22 111.125 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -44.27 123.85 3.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.466 . . . . 71.31 110.873 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 188' ' ' PHE . . . . . 0.509 ' HD2' ' HB3' ' A' ' 108' ' ' LEU . 1.4 t80 -59.83 -38.45 82.06 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.098 -0.501 . . . . 75.45 110.872 -179.92 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . 0.424 HD22 HD13 ' A' ' 108' ' ' LEU . 0.0 OUTLIER -67.34 -47.61 69.97 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.129 -0.487 . . . . 60.14 110.895 179.984 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 65.6 t80 -67.54 -39.86 84.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.248 -0.433 . . . . 74.22 110.931 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -72.5 -35.21 68.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.091 -0.504 . . . . 61.32 111.121 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 192' ' ' ALA . . . . . 0.503 ' O ' ' HB2' ' A' ' 196' ' ' LEU . . . -57.37 -44.69 84.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 52.32 111.079 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 13.6 m -58.28 -43.41 88.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.225 -0.443 . . . . 72.43 111.137 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 34.1 t60 -72.82 -42.97 63.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.2 -0.455 . . . . 71.44 110.863 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -69.87 -47.72 61.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.221 -0.445 . . . . 71.01 111.106 179.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 196' ' ' LEU . . . . . 0.507 ' N ' HD23 ' A' ' 196' ' ' LEU . 4.5 mm? -64.62 -33.58 76.28 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.217 -0.447 . . . . 74.52 110.865 -179.942 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -63.58 -26.55 69.85 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.701 -0.761 . . . . 62.43 112.475 179.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 198' ' ' HIS . . . . . . . . . . . . . 4.3 m-70 -67.07 -42.66 84.31 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.825 0.345 . . . . 75.21 110.813 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -61.85 -20.53 63.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.225 -0.443 . . . . 73.13 110.865 -179.755 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 1.7 mt -86.37 3.2 44.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.091 -0.504 . . . . 75.12 110.872 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 84.1 -9.35 63.79 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.714 -0.755 . . . . 50.41 112.466 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 202' ' ' MET . . . . . . . . . . . . . 42.1 tpp -54.72 153.93 5.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.847 0.356 . . . . 71.04 110.914 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -117.68 177.97 16.79 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.699 -0.762 . . . . 64.44 112.467 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 45.6 m-70 -77.92 149.97 34.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.799 0.333 . . . . 74.32 110.833 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 66.2 m -121.86 149.91 42.69 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.18 -0.463 . . . . 72.42 110.835 -179.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 79.1 p -87.79 -4.37 58.88 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.126 -0.488 . . . . 72.22 110.849 -179.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -71.62 130.45 87.23 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.614 0.721 . . . . 65.11 110.858 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.72 -8.28 23.19 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.688 2.258 . . . . 74.53 112.351 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -116.26 11.09 15.0 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.145 -0.48 . . . . 63.52 110.915 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 210' ' ' ALA . . . . . 0.415 ' O ' ' HB2' ' A' ' 213' ' ' TYR . . . -87.18 146.02 26.18 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.132 -0.486 . . . . 64.4 111.088 179.838 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 211' ' ' VAL . . . . . 0.456 HG12 ' HG3' ' A' ' 212' ' ' MET . 0.4 OUTLIER -70.47 -25.07 26.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.196 -0.456 . . . . 75.23 111.104 179.902 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 212' ' ' MET . . . . . 0.456 ' HG3' HG12 ' A' ' 211' ' ' VAL . 0.4 OUTLIER -86.35 3.19 44.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.199 -0.455 . . . . 75.22 110.901 179.937 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 213' ' ' TYR . . . . . 0.415 ' HB2' ' O ' ' A' ' 210' ' ' ALA . 2.0 t80 -54.85 110.23 2.05 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-O 121.636 0.731 . . . . 73.43 110.887 -179.88 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.77 -18.55 36.89 Favored 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.705 2.27 . . . . 63.01 112.41 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.27 53.6 2.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.184 -0.462 . . . . 74.24 111.116 -179.959 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -65.13 123.81 20.5 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.26 -0.427 . . . . 74.42 110.914 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . 168.42 39.42 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.774 -0.727 . . . . 74.22 112.529 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -113.82 -37.63 4.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.865 0.364 . . . . 64.22 110.91 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . 171.24 166.05 29.47 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.701 -0.761 . . . . 73.55 112.472 179.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 220' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -103.0 101.41 21.24 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.552 0.692 . . . . 73.41 110.912 -179.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 115.44 4.1 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.633 2.222 . . . . 74.21 112.369 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -71.46 -18.25 62.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.203 -0.453 . . . . 75.43 110.92 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 -116.14 -36.2 4.15 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.219 -0.446 . . . . 70.33 110.887 -179.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER 66.03 143.21 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.143 -0.48 . . . . 71.11 110.841 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.37 147.89 35.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.11 -0.495 . . . . 65.02 110.917 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 10.1 mt -75.45 148.92 38.68 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.203 -0.453 . . . . 62.53 110.924 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 227' ' ' SER . . . . . 0.413 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 2.1 t -87.2 155.3 20.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.241 -0.436 . . . . 74.21 110.84 -179.926 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -64.11 -66.25 0.57 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.099 -0.5 . . . . 74.54 110.957 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -55.69 -25.62 40.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.181 -0.463 . . . . 74.2 110.904 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -68.84 -48.45 63.45 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.169 -0.469 . . . . 74.23 110.855 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 231' ' ' ILE . . . . . 0.413 HG12 ' HG2' ' A' ' 119' ' ' GLU . 12.0 mt -68.21 -42.26 84.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.231 -0.44 . . . . 73.41 111.067 180.0 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 15.2 pttm -65.9 -32.14 73.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.199 -0.455 . . . . 73.32 110.929 179.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -62.62 -46.63 93.34 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.756 -0.735 . . . . 65.45 112.472 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 12.2 tt -72.93 -30.54 32.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.779 0.323 . . . . 74.41 111.101 -179.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -70.96 -24.71 62.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.174 -0.466 . . . . 71.13 110.879 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 236' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.1 -26.82 60.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.218 -0.446 . . . . 74.41 110.903 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 237' ' ' LEU . . . . . . . . . . . . . 10.3 tt -97.25 -24.54 15.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.224 -0.443 . . . . 75.41 110.937 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 238' ' ' TYR . . . . . 0.477 ' HH ' ' N ' ' A' ' 84' ' ' TRP . 6.3 m-85 -92.36 -35.07 13.92 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.228 -0.442 . . . . 54.42 110.913 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -129.56 -120.08 2.21 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.791 -0.718 . . . . 72.22 112.524 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.41 135.1 33.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.777 0.322 . . . . 75.42 110.883 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.43 176.7 5.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.268 -0.424 . . . . 73.34 110.867 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 1.9 t -161.46 -53.23 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.194 -0.457 . . . . 62.43 110.835 -179.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -177.94 110.91 0.07 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.122 -0.49 . . . . 72.13 110.906 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 7.6 p -165.93 175.86 8.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.194 -0.457 . . . . 71.41 110.912 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.6 -169.9 2.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.097 -0.501 . . . . 75.43 110.895 -179.952 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.09 -170.17 3.56 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.206 -0.452 . . . . 72.11 110.843 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 6.8 mmmt . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.186 -0.461 . . . . 74.13 110.864 179.842 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 302' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' -2' ' ' LEU . . . . . 0.468 ' N ' ' HD2' ' A' ' -1' ' ' PRO . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.123 0 CA-C-O 121.551 0.691 . . . . 73.02 110.915 . . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' -1' ' ' PRO . . . . . 0.468 ' HD2' ' N ' ' A' ' -2' ' ' LEU . 52.9 Cg_endo -69.85 -172.1 0.55 Allowed 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.711 2.274 . . . . 73.21 112.308 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -138.89 160.57 62.37 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.572 0.701 . . . . 75.23 110.935 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.67 130.17 18.98 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.727 2.285 . . . . 64.24 112.409 179.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -147.6 -42.15 0.17 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.298 -0.41 . . . . 62.24 110.851 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -61.07 -18.58 58.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.259 -0.428 . . . . 74.01 110.869 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.35 -33.95 66.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.181 -0.463 . . . . 71.4 111.115 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -55.82 -33.93 60.58 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.756 -0.735 . . . . 62.21 112.539 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -108.94 20.31 29.12 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.818 -0.706 . . . . 54.42 112.48 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 15.9 ptp -59.75 164.1 3.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.823 0.344 . . . . 72.23 110.876 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -73.01 154.64 40.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.282 -0.417 . . . . 73.24 110.856 -179.801 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -54.4 -31.94 56.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.126 -0.488 . . . . 73.44 110.879 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.55 -42.7 86.74 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.147 -0.479 . . . . 72.33 110.931 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 45.1 mm-40 -62.67 -45.26 93.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.204 -0.453 . . . . 72.14 110.907 179.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 11.6 t-105 -73.15 -31.16 64.09 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.195 -0.457 . . . . 71.22 110.954 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -73.28 -35.37 66.15 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.217 -0.447 . . . . 72.51 110.861 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -62.96 -36.92 85.06 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.229 -0.441 . . . . 74.32 110.92 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.16 -41.2 87.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 74.22 111.078 179.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -72.92 -42.99 62.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.245 -0.434 . . . . 73.12 110.911 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -65.86 -31.82 72.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.219 -0.446 . . . . 72.4 110.847 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -70.33 -35.86 73.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.172 -0.467 . . . . 75.11 110.85 -179.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.9 mt -71.06 -21.03 62.3 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.157 -0.474 . . . . 75.43 110.952 179.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.0 ptmt -75.35 -29.88 60.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.128 -0.487 . . . . 75.45 110.856 179.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.7 ptp180 -86.2 -27.22 24.65 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.259 -0.428 . . . . 74.22 110.839 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -59.62 -21.24 60.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.207 -0.451 . . . . 75.2 110.885 -179.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -120.94 46.2 2.08 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.164 -0.471 . . . . 74.4 110.939 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.4 mt 64.23 -168.62 0.2 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.153 -0.476 . . . . 75.43 110.903 179.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -90.79 89.72 7.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 71.41 110.963 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -117.16 112.63 21.11 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.115 -0.493 . . . . 74.25 110.807 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -85.12 -6.41 59.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.158 -0.474 . . . . 62.15 110.853 -179.812 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -67.25 -11.67 58.09 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.187 -0.46 . . . . 74.51 110.882 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.4 m -85.66 8.6 18.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.15 -0.477 . . . . 72.53 111.188 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 10.9 ttpt -51.46 170.23 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.187 -0.46 . . . . 74.12 110.939 179.881 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 6.6 m120 66.3 149.15 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.238 -0.437 . . . . 74.52 110.899 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.11 -22.77 58.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.214 -0.448 . . . . 71.02 111.054 179.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -57.83 -22.1 45.85 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.237 -0.438 . . . . 71.33 110.878 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 68.8 m -86.73 -19.47 29.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.213 -0.449 . . . . 74.02 110.857 -179.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.423 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 8.6 tt -57.52 -45.23 85.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.105 -0.498 . . . . 74.54 110.885 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.44 -51.25 70.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.204 -0.453 . . . . 73.13 110.894 179.918 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -66.04 -36.6 83.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.171 -0.468 . . . . 71.12 111.126 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.419 ' O ' ' HG3' ' A' ' 41' ' ' GLU . 0.0 OUTLIER -65.59 -49.08 70.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.447 . . . . 74.43 110.912 179.934 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.423 ' HG ' ' O ' ' A' ' 35' ' ' LEU . 4.6 mt -63.19 -35.38 80.11 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.156 -0.475 . . . . 74.44 110.914 179.924 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.8 tttt -68.48 -45.73 71.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.249 -0.432 . . . . 74.2 110.876 179.83 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.557 ' HG3' ' N ' ' A' ' 42' ' ' MET . 0.0 OUTLIER -59.93 -31.87 70.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.193 -0.458 . . . . 75.11 110.946 179.949 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.557 ' N ' ' HG3' ' A' ' 41' ' ' GLU . 38.2 ttp -68.5 -34.09 75.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.142 -0.481 . . . . 63.43 110.901 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.418 ' HG3' ' HA ' ' A' ' 51' ' ' THR . 1.2 mm-40 -60.65 -39.44 88.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.209 -0.45 . . . . 75.32 110.92 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.1 mmpt? -68.37 -28.36 67.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.47 . . . . 75.11 110.874 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 28.1 t80 -70.28 -45.01 67.2 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.18 -0.464 . . . . 73.32 110.86 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 17.2 m-85 -81.98 -35.12 29.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.174 -0.466 . . . . 70.43 110.913 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 102.73 -7.13 52.9 Favored Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.75 -0.738 . . . . 64.42 112.466 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -59.82 138.78 90.33 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.565 0.697 . . . . 74.31 110.968 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.73 -53.01 0.29 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.651 2.234 . . . . 74.5 112.374 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -51.32 108.22 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.215 -0.448 . . . . 72.24 111.126 179.881 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.418 ' HA ' ' HG3' ' A' ' 43' ' ' GLN . 41.4 p -109.0 164.37 12.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.178 -0.464 . . . . 73.25 111.118 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 59.56 17.65 41.62 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.723 -0.751 . . . . 64.24 112.475 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -114.57 161.05 18.56 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.857 0.361 . . . . 75.23 110.837 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 26.8 tp -168.56 84.99 0.17 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.206 -0.452 . . . . 74.32 110.903 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.4 p30 175.55 -29.24 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.148 -0.478 . . . . 61.31 110.91 179.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 28.5 t -90.84 -100.52 0.1 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.156 -0.474 . . . . 75.25 110.902 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -85.05 -28.89 25.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.155 -0.475 . . . . 74.13 110.884 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.421 ' O ' HG12 ' A' ' 61' ' ' ILE . 66.6 t -64.98 -41.56 92.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.188 -0.46 . . . . 72.2 111.103 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -74.59 -31.45 27.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.206 -0.452 . . . . 75.2 111.164 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.03 -33.09 70.34 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.121 -0.49 . . . . 73.45 110.91 179.925 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.421 HG12 ' O ' ' A' ' 58' ' ' VAL . 0.4 OUTLIER -76.45 -29.56 18.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.125 -0.489 . . . . 74.52 111.093 -179.975 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 5.2 mmt -64.41 -37.35 87.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.144 -0.48 . . . . 74.01 110.88 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -86.58 -23.29 25.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.26 -0.427 . . . . 45.15 110.918 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -85.08 124.97 71.58 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.588 0.709 . . . . 75.32 110.842 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 160.49 49.51 Favored 'Trans proline' 0 C--O 1.233 0.254 0 C-N-CA 122.683 2.255 . . . . 72.11 112.406 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -155.53 -77.46 0.1 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.31 -0.405 . . . . 73.22 110.914 -179.957 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -145.18 155.18 43.13 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.119 -0.491 . . . . 72.31 110.843 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.583 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -97.53 11.81 64.86 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.727 -0.749 . . . . 64.23 112.534 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.436 ' CG1' ' HD2' ' A' ' 70' ' ' PRO . 0.9 OUTLIER -92.37 136.47 25.51 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.703 0.763 . . . . 74.23 111.139 -179.958 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . 0.436 ' HD2' ' CG1' ' A' ' 69' ' ' VAL . 54.1 Cg_endo -69.75 155.1 66.87 Favored 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.691 2.26 . . . . 63.44 112.338 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -92.66 15.49 14.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.224 -0.444 . . . . 74.45 110.88 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -122.76 129.06 75.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.183 -0.462 . . . . 73.52 111.108 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -131.1 170.66 14.23 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.194 -0.457 . . . . 73.13 111.119 179.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -136.74 142.46 43.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.215 -0.448 . . . . 74.13 110.868 -179.839 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 39.3 p90 -49.23 121.34 4.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.181 -0.463 . . . . 71.51 110.874 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.56 179.31 0.17 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.151 -0.477 . . . . 74.2 110.832 -179.899 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -142.9 -53.79 0.4 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.127 -0.488 . . . . 70.34 110.938 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . 0.475 ' CB ' ' CD ' ' A' ' 79' ' ' PRO . 1.7 m-85 -70.87 -61.53 2.36 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.671 0.748 . . . . 71.24 110.818 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.475 ' CD ' ' CB ' ' A' ' 78' ' ' PHE . 53.5 Cg_endo -69.8 145.53 57.19 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.671 2.247 . . . . 73.34 112.336 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 33.3 m120 -88.38 129.38 35.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.223 -0.444 . . . . 74.43 110.914 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 64.2 153.7 0.12 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.647 0.737 . . . . 70.4 110.892 -179.845 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 -50.46 0.46 Allowed 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.75 2.3 . . . . 72.25 112.378 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 2.6 mttm -84.08 161.74 20.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.157 -0.474 . . . . 72.53 110.895 179.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . 0.442 ' NE1' ' O ' ' A' ' 199' ' ' SER . 40.6 m0 -49.63 123.48 7.87 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.158 -0.474 . . . . 73.31 110.983 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 9.9 t -115.19 -19.43 10.82 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.241 -0.436 . . . . 71.34 111.128 -179.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -53.46 160.98 1.08 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.216 -0.447 . . . . 73.12 110.832 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 2.8 ptmt -74.03 -30.61 62.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.064 -0.516 . . . . 71.12 110.892 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -152.72 144.54 15.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.235 -0.439 . . . . 74.14 111.105 179.938 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 12.2 t -130.77 140.95 47.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.22 -0.445 . . . . 72.25 111.101 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 11.0 p -117.18 167.94 10.74 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.088 -0.505 . . . . 75.51 111.128 -180.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.403 ' HB3' ' HB ' ' A' ' 134' ' ' ILE . 4.9 p90 -150.35 146.55 26.8 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.198 -0.456 . . . . 70.51 110.961 -179.856 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 4.5 ttt-85 -146.29 136.24 23.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.165 -0.471 . . . . 74.3 110.854 -179.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.43 HD12 ' HA ' ' A' ' 106' ' ' ASP . 3.4 mp -74.76 135.54 27.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.169 -0.469 . . . . 72.4 111.195 179.903 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.402 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 19.3 t -89.15 -40.7 13.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.2 -0.454 . . . . 74.41 111.112 179.914 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 5.6 t -144.56 163.4 34.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.208 -0.451 . . . . 64.24 110.857 -179.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 11.2 p90 -110.58 152.47 26.39 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.138 -0.483 . . . . 74.1 110.921 -179.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' THR . . . . . 0.448 ' O ' ' O ' ' A' ' 100' ' ' LEU . 0.2 OUTLIER -82.68 140.99 32.8 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.117 -0.492 . . . . 75.33 111.173 -179.989 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.92 -7.8 52.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.197 -0.456 . . . . 72.14 110.923 179.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -96.42 -26.1 15.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.251 -0.431 . . . . 74.13 110.889 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.448 ' O ' ' O ' ' A' ' 97' ' ' THR . 0.9 OUTLIER -133.54 153.6 80.38 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.591 0.71 . . . . 72.52 111.006 -179.956 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . 0.4 ' HB2' HG23 ' A' ' 103' ' ' ILE . 53.9 Cg_endo -69.71 150.89 69.13 Favored 'Trans proline' 0 C--O 1.231 0.159 0 C-N-CA 122.703 2.269 . . . . 73.11 112.365 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 15.9 t-160 -52.74 -27.38 17.46 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.221 -0.445 . . . . 74.11 110.866 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.4 HG23 ' HB2' ' A' ' 101' ' ' PRO . 0.0 OUTLIER -75.72 -39.43 39.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.18 -0.463 . . . . 74.02 111.109 -179.956 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 3.1 m -69.33 -39.13 78.37 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.114 -0.493 . . . . 54.24 111.154 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 92.0 t -72.61 -44.83 60.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.224 -0.444 . . . . 73.13 111.119 179.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.582 ' O ' HG21 ' A' ' 109' ' ' VAL . 3.9 t0 -66.25 -41.91 89.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.215 -0.448 . . . . 63.44 110.841 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 6.6 ptm180 -69.9 -33.8 72.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 75.02 110.829 -179.839 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.554 ' HB3' ' HD2' ' A' ' 188' ' ' PHE . 0.0 OUTLIER -60.73 -48.95 79.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.196 -0.456 . . . . 75.05 110.882 -179.96 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.582 HG21 ' O ' ' A' ' 106' ' ' ASP . 1.3 m -55.61 -41.96 66.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.181 -0.463 . . . . 72.31 111.112 179.893 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.469 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 42.7 t -69.97 -34.1 72.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.142 -0.481 . . . . 72.14 110.874 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.46 -33.33 74.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.111 -0.495 . . . . 74.35 110.882 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -94.02 -40.97 9.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.288 -0.415 . . . . 74.32 111.12 179.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.47 -32.91 74.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.179 -0.464 . . . . 74.11 110.969 179.937 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -67.9 -38.06 82.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.226 -0.443 . . . . 75.15 110.946 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.41 -34.62 77.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.083 -0.508 . . . . 74.0 110.881 179.871 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' TRP . . . . . 0.41 ' CZ3' ' SD ' ' A' ' 202' ' ' MET . 8.4 m95 -65.98 -52.29 50.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.198 -0.455 . . . . 75.23 110.929 -179.968 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -63.94 -37.22 94.31 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.728 -0.749 . . . . 73.44 112.453 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.41 -16.31 45.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.758 0.313 . . . . 74.42 110.888 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.433 ' HG2' HD13 ' A' ' 226' ' ' LEU . 0.2 OUTLIER -101.2 12.13 38.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.278 -0.419 . . . . 75.55 110.938 179.938 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.526 ' C ' ' H ' ' A' ' 122' ' ' LEU . 5.1 pt -149.7 149.36 28.07 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.59 0.709 . . . . 71.34 111.113 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.72 25.71 0.17 Allowed 'Trans proline' 0 C--O 1.231 0.166 0 C-N-CA 122.668 2.245 . . . . 75.35 112.354 179.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.526 ' H ' ' C ' ' A' ' 120' ' ' ILE . 9.9 mt -80.43 -157.53 0.15 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.193 -0.458 . . . . 73.22 110.908 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.416 ' H ' ' HB3' ' A' ' 122' ' ' LEU . 4.2 t60 -163.78 133.59 4.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 74.12 110.855 179.868 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 23.4 m-30 -119.59 142.58 48.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.242 -0.436 . . . . 75.54 110.899 -179.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -118.85 141.92 48.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.157 -0.474 . . . . 75.14 110.916 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.42 149.48 30.13 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.133 -0.485 . . . . 74.04 110.896 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . 0.403 HG13 ' CB ' ' A' ' 132' ' ' ALA . 27.4 m -103.21 126.5 57.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.267 -0.424 . . . . 50.13 111.086 179.933 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -143.55 -11.79 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.237 -0.438 . . . . 74.43 111.18 179.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -153.78 109.22 3.2 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.178 -0.464 . . . . 73.32 110.931 179.967 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.59 -161.2 13.69 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.745 -0.74 . . . . 62.11 112.445 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -101.82 155.97 17.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.767 0.317 . . . . 71.11 111.117 -179.818 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . 0.403 ' CB ' HG13 ' A' ' 127' ' ' VAL . . . -111.93 165.3 12.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 72.32 111.132 179.84 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -75.9 -62.02 1.73 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.202 -0.454 . . . . 75.41 110.869 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . 0.521 ' CD1' ' N ' ' A' ' 134' ' ' ILE . 1.3 mp -82.57 107.5 14.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.254 -0.43 . . . . 71.04 111.117 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' MET . . . . . 0.402 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 11.1 mmm -92.94 131.78 37.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.221 -0.445 . . . . 72.43 110.876 179.797 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.415 HD11 HG21 ' A' ' 134' ' ' ILE . 0.3 OUTLIER -113.34 95.33 3.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.251 -0.432 . . . . 70.04 111.141 179.956 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -136.1 165.51 24.88 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.796 -0.716 . . . . 63.34 112.499 179.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 43.5 m-85 -106.42 149.68 26.79 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.859 0.361 . . . . 74.01 110.861 -179.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . 170.49 166.42 0.07 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.138 -0.483 . . . . 71.21 111.113 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -104.6 173.53 6.26 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.213 -0.449 . . . . 72.34 110.87 -179.916 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -55.13 -17.45 10.54 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.797 -0.716 . . . . 74.24 112.454 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -87.33 12.97 10.68 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.795 0.331 . . . . 75.03 111.086 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 6.1 p80 -81.44 -4.38 55.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.235 -0.438 . . . . 73.45 110.788 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 124.68 7.31 6.23 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.778 -0.725 . . . . 60.43 112.521 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 29.1 m-20 -111.19 163.64 13.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.856 0.36 . . . . 72.14 110.854 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -87.44 176.89 7.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.173 -0.467 . . . . 64.54 110.854 -179.74 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 66.46 127.98 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.687 0.755 . . . . 73.4 110.933 -179.921 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.87 145.42 56.45 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.677 2.251 . . . . 74.53 112.332 179.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 149' ' ' PHE . . . . . 0.41 ' CE1' ' HB2' ' A' ' 173' ' ' ASP . 0.1 OUTLIER -90.87 -31.61 16.37 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.186 -0.461 . . . . 70.0 110.894 -179.985 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 74.39 -1.67 3.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.145 -0.48 . . . . 72.24 110.855 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . 0.638 ' O ' 'CA ' ' A' ' 302' ' ' ' CA' . . . 50.04 -108.52 0.5 Allowed Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.721 -0.752 . . . . 75.42 112.48 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -69.71 139.41 40.33 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.707 2.271 . . . . 75.11 112.401 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 103.29 -153.76 18.06 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.712 -0.756 . . . . 70.32 112.484 179.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 154' ' ' ASN . . . . . 0.412 ' O ' ' CB ' ' A' ' 155' ' ' THR . 4.4 p30 -42.77 155.06 0.06 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.904 0.383 . . . . 74.45 110.872 -179.883 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 155' ' ' THR . . . . . 0.412 ' CB ' ' O ' ' A' ' 154' ' ' ASN . 0.2 OUTLIER 78.44 114.01 0.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.152 -0.476 . . . . 63.14 111.182 -179.95 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . 0.441 HD13 HG13 ' A' ' 186' ' ' ILE . 1.1 tp -101.49 -51.79 3.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.22 -0.446 . . . . 75.02 110.94 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . 0.583 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -159.65 148.46 17.74 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.11 -0.495 . . . . 73.44 111.113 179.812 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 37.0 p-80 -110.32 123.2 49.39 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.215 -0.448 . . . . 74.34 110.868 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -110.36 160.17 16.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.263 -0.426 . . . . 74.42 111.115 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 16.6 m-30 -118.91 163.32 17.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.205 -0.452 . . . . 75.31 110.852 -179.894 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -88.09 165.02 31.22 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.543 0.687 . . . . 71.14 111.127 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 162' ' ' PRO . . . . . 0.46 ' HD3' ' O ' ' A' ' 199' ' ' SER . 53.6 Cg_endo -69.76 71.61 1.51 Allowed 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.629 2.219 . . . . 74.44 112.377 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -127.91 108.82 0.97 Allowed Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.77 -0.729 . . . . 72.32 112.491 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 1.4 p 59.23 173.74 0.07 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.79 0.329 . . . . 73.1 111.104 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -55.59 -33.74 59.56 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.667 -0.778 . . . . 74.03 112.514 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -71.28 -18.03 62.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.83 0.348 . . . . 75.02 110.89 -179.929 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -88.93 167.29 34.56 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.762 -0.732 . . . . 43.43 112.559 179.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 168' ' ' GLY . . . . . 0.442 ' O ' HG13 ' A' ' 134' ' ' ILE . . . 72.95 15.83 78.36 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.772 -0.728 . . . . 74.31 112.468 -179.893 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -85.76 141.36 29.74 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.823 0.344 . . . . 63.41 110.876 -179.957 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -111.8 130.14 55.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.24 -0.436 . . . . 74.21 111.126 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 49.6 m170 -131.24 132.49 44.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.215 -0.448 . . . . 72.53 110.927 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 31.8 m-85 -111.52 138.02 48.59 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.208 -0.451 . . . . 71.44 110.859 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 173' ' ' ASP . . . . . 0.41 ' HB2' ' CE1' ' A' ' 149' ' ' PHE . 65.7 t0 -65.28 96.02 0.21 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.193 -0.458 . . . . 74.11 110.82 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.66 -16.16 9.83 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.234 -0.439 . . . . 74.45 110.911 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -79.01 -16.35 57.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.122 -0.49 . . . . 73.32 110.831 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 23.7 mm-40 -84.61 -171.48 3.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.22 -0.445 . . . . 71.41 110.956 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 177' ' ' ARG . . . . . 0.409 ' HG3' ' HA3' ' A' ' 185' ' ' GLY . 0.0 OUTLIER -115.91 118.66 33.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.156 -0.474 . . . . 74.32 110.854 -179.941 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 45.8 m95 -117.01 144.3 44.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.145 -0.479 . . . . 74.32 110.909 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 12.3 t -178.04 163.65 1.76 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.211 -0.449 . . . . 74.13 111.132 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -125.25 -69.7 0.78 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.274 -0.421 . . . . 61.52 110.885 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -63.2 -13.24 48.27 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.788 -0.72 . . . . 62.41 112.478 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -93.14 -24.31 18.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.939 0.399 . . . . 74.0 110.85 -179.788 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 86.6 p 37.93 43.74 0.55 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 64.12 110.888 -179.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -107.84 -33.54 7.21 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.071 -0.513 . . . . 74.43 110.919 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 185' ' ' GLY . . . . . 0.409 ' HA3' ' HG3' ' A' ' 177' ' ' ARG . . . -112.67 -145.11 9.44 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.711 -0.756 . . . . 74.22 112.525 179.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 186' ' ' ILE . . . . . 0.441 HG13 HD13 ' A' ' 156' ' ' LEU . 11.5 mm -78.87 97.8 2.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.9 0.381 . . . . 73.22 111.121 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 22.1 m-80 -44.55 118.17 1.49 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.216 -0.447 . . . . 71.31 110.884 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 188' ' ' PHE . . . . . 0.554 ' HD2' ' HB3' ' A' ' 108' ' ' LEU . 1.4 t80 -53.96 -36.37 62.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.145 -0.479 . . . . 75.45 110.877 179.998 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.18 -47.16 71.76 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.164 -0.471 . . . . 60.14 110.898 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 6.2 t80 -69.24 -38.93 78.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.186 -0.461 . . . . 74.22 110.92 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -72.01 -35.83 69.53 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.125 -0.489 . . . . 61.32 111.134 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 192' ' ' ALA . . . . . 0.519 ' O ' ' HB2' ' A' ' 196' ' ' LEU . . . -56.98 -45.0 83.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.195 -0.457 . . . . 52.32 111.078 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -58.52 -41.25 85.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.217 -0.447 . . . . 72.43 111.153 -179.919 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 13.7 t-160 -72.77 -45.41 58.72 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.18 -0.464 . . . . 71.44 110.877 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -69.42 -47.41 64.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.206 -0.452 . . . . 71.01 111.095 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 196' ' ' LEU . . . . . 0.519 ' HB2' ' O ' ' A' ' 192' ' ' ALA . 4.0 mm? -66.26 -43.18 87.19 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.244 -0.434 . . . . 74.52 110.903 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -60.67 -24.29 61.94 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.79 -0.719 . . . . 62.43 112.472 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 198' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -68.08 -42.69 80.01 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.807 0.337 . . . . 75.21 110.928 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 199' ' ' SER . . . . . 0.46 ' O ' ' HD3' ' A' ' 162' ' ' PRO . 41.4 t -62.15 -23.3 66.5 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.182 -0.463 . . . . 73.13 110.91 -179.854 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 200' ' ' LEU . . . . . 0.424 HD23 ' CE2' ' A' ' 84' ' ' TRP . 1.6 mt -85.23 2.58 43.25 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.075 -0.511 . . . . 75.12 110.965 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 84.91 -9.37 66.14 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.817 -0.706 . . . . 50.41 112.434 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 202' ' ' MET . . . . . 0.415 ' CE ' ' HB ' ' A' ' 234' ' ' ILE . 0.0 OUTLIER -57.55 130.47 46.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.782 0.325 . . . . 71.04 110.915 179.962 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -101.03 175.12 25.92 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.777 -0.725 . . . . 64.44 112.451 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 17.3 m-70 -68.09 163.47 22.4 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.766 0.317 . . . . 74.32 110.909 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -127.06 156.36 41.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.228 -0.442 . . . . 72.42 110.899 -179.788 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 5.6 p -87.65 -4.28 58.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.208 -0.451 . . . . 72.22 110.817 -179.75 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 -71.29 133.62 85.3 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-O 121.635 0.731 . . . . 65.11 110.811 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 -6.0 17.55 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.682 2.255 . . . . 74.53 112.297 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 -127.64 26.49 5.91 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.252 -0.431 . . . . 63.52 110.841 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 210' ' ' ALA . . . . . 0.409 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.4 145.65 26.21 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.234 -0.439 . . . . 64.4 111.071 179.821 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -67.49 -27.35 38.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.207 -0.451 . . . . 75.23 111.128 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 35.6 mmm -93.83 6.13 49.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.454 . . . . 75.22 110.866 179.881 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 213' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -55.91 111.87 3.66 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.666 0.746 . . . . 73.43 110.955 -179.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.79 -17.79 37.24 Favored 'Trans proline' 0 C--N 1.341 0.135 0 C-N-CA 122.688 2.259 . . . . 63.01 112.32 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.13 60.48 5.93 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.232 -0.44 . . . . 74.24 111.1 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -46.6 122.67 4.34 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.191 -0.459 . . . . 74.42 110.914 -179.923 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -94.15 175.47 34.97 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.782 -0.723 . . . . 74.22 112.468 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -68.4 -74.47 0.12 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.841 0.353 . . . . 64.22 110.903 -179.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . -62.07 105.45 0.95 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.784 -0.722 . . . . 73.55 112.439 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 220' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -91.36 153.6 44.4 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.678 0.751 . . . . 73.41 110.857 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.7 139.17 39.76 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.622 2.214 . . . . 74.21 112.346 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -81.5 -22.74 37.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.25 -0.432 . . . . 75.43 110.91 179.992 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 25.1 t30 -114.32 -40.14 3.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.215 -0.448 . . . . 70.33 110.874 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER 66.96 134.62 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.166 -0.47 . . . . 71.11 110.864 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.86 158.59 43.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.087 -0.506 . . . . 65.02 110.963 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . 0.433 HD13 ' HG2' ' A' ' 119' ' ' GLU . 50.4 mt -69.74 148.92 48.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.231 -0.44 . . . . 62.53 110.908 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 227' ' ' SER . . . . . 0.409 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 0.0 OUTLIER -87.17 148.49 25.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.173 -0.467 . . . . 74.21 110.886 -179.96 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.7 -64.07 0.96 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.158 -0.474 . . . . 74.54 110.919 -179.953 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -55.66 -27.68 51.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.171 -0.468 . . . . 74.2 110.852 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -70.05 -49.36 51.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.157 -0.474 . . . . 74.23 110.857 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 231' ' ' ILE . . . . . . . . . . . . . 8.3 mt -69.39 -44.27 80.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.22 -0.446 . . . . 73.41 111.135 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 1.2 ptmt -56.41 -32.58 64.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.139 -0.482 . . . . 73.32 110.901 179.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -64.95 -50.54 57.5 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.791 -0.719 . . . . 65.45 112.464 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 234' ' ' ILE . . . . . 0.415 ' HB ' ' CE ' ' A' ' 202' ' ' MET . 8.0 tt -73.82 -31.11 30.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.817 0.342 . . . . 74.41 111.16 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -61.67 -23.7 66.25 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.158 -0.474 . . . . 71.13 110.889 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 236' ' ' LYS . . . . . 0.427 ' HD3' ' N ' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.39 -24.61 59.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.252 -0.431 . . . . 74.41 110.884 179.947 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 237' ' ' LEU . . . . . 0.427 ' N ' ' HD3' ' A' ' 236' ' ' LYS . 9.2 tt -93.02 -30.27 15.4 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.252 -0.431 . . . . 75.41 110.918 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 238' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -92.27 -35.4 13.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.167 -0.47 . . . . 54.42 110.921 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -115.62 -121.36 3.4 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.679 -0.772 . . . . 72.22 112.384 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 4.8 tttm -97.68 131.56 44.12 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.817 0.342 . . . . 75.42 110.919 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 7.6 ptt180 -50.59 162.23 0.26 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.189 -0.46 . . . . 73.34 110.818 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -172.92 -52.43 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 62.43 110.863 -179.831 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -97.0 -170.96 2.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.126 -0.488 . . . . 72.13 110.875 -179.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -140.48 -73.21 0.35 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 71.41 110.816 -179.828 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 63.09 175.93 0.15 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.177 -0.465 . . . . 75.43 110.931 -179.885 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 36.6 pttt -131.28 34.0 4.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.217 -0.447 . . . . 72.11 110.951 179.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.218 -0.446 . . . . 74.13 110.915 179.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 302' ' ' ' CA' . . . . . 0.638 'CA ' ' O ' ' A' ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' -2' ' ' LEU . . . . . . . . . . . . . 4.5 mm? . . . . . 0 C--O 1.232 0.132 0 CA-C-O 121.636 0.731 . . . . 73.02 110.91 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' -1' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.85 -173.27 0.7 Allowed 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.673 2.249 . . . . 73.21 112.319 179.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 2.4 mp -115.84 160.61 34.46 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.606 0.717 . . . . 75.23 110.89 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.67 -171.74 0.5 Allowed 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.643 2.229 . . . . 64.24 112.371 179.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 71.5 -69.49 0.18 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.228 -0.442 . . . . 62.24 110.918 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -56.01 -32.43 63.98 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.231 -0.44 . . . . 74.01 110.839 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.95 -34.03 67.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.207 -0.452 . . . . 71.4 111.103 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -55.91 -31.62 58.55 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.675 -0.774 . . . . 62.21 112.499 -179.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -107.84 17.86 35.13 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.793 -0.718 . . . . 54.42 112.497 -179.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 3.1 tpt -66.03 164.2 15.81 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.779 0.323 . . . . 72.23 110.883 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -52.05 147.38 7.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.26 -0.427 . . . . 73.24 110.868 -179.802 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.26 -31.95 70.7 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.149 -0.478 . . . . 73.44 110.899 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.0 -41.96 99.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.154 -0.475 . . . . 72.33 110.938 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 36.0 mm-40 -61.92 -44.61 96.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.154 -0.476 . . . . 72.14 110.918 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 6.6 t-105 -73.07 -31.32 64.32 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.156 -0.474 . . . . 71.22 110.889 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -73.32 -36.39 66.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.294 -0.412 . . . . 72.51 110.919 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -63.12 -38.09 89.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.158 -0.474 . . . . 74.32 110.851 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.23 -43.66 94.27 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.207 -0.451 . . . . 74.22 111.062 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -62.2 -43.09 99.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.215 -0.448 . . . . 73.12 110.855 -179.89 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -73.66 -31.52 63.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.208 -0.451 . . . . 72.4 110.888 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -70.74 -36.41 73.13 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.23 -0.441 . . . . 75.11 110.89 -179.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -71.91 -21.04 61.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.149 -0.478 . . . . 75.43 110.973 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 5.1 ptmt -74.85 -34.62 62.31 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.156 -0.475 . . . . 75.45 110.918 179.822 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.04 -27.17 48.71 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.212 -0.449 . . . . 74.22 110.875 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -75.42 2.12 12.24 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.207 -0.451 . . . . 75.2 110.916 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.4 ' O ' ' HB2' ' A' ' 70' ' ' PRO . 7.8 m-85 -118.81 -75.59 0.58 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.166 -0.47 . . . . 74.4 110.976 -179.842 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 12.0 mt -161.78 24.63 0.12 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.113 -0.494 . . . . 75.43 110.888 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 4.2 t80 49.21 89.5 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.185 -0.461 . . . . 71.41 110.852 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -125.32 111.95 15.78 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.151 -0.477 . . . . 74.25 110.87 179.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.27 -9.32 57.86 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.257 -0.429 . . . . 62.15 110.808 -179.747 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -82.39 -15.32 53.11 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.186 -0.461 . . . . 74.51 110.872 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.4 m -88.28 9.4 23.27 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.171 -0.468 . . . . 72.53 111.138 -179.883 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -79.91 100.04 7.87 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.183 -0.462 . . . . 74.12 110.883 179.92 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -167.5 160.85 13.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.231 -0.44 . . . . 74.52 110.896 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.89 -38.11 61.97 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.148 -0.478 . . . . 71.02 111.136 179.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.8 m120 -76.28 -49.05 18.03 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.299 -0.409 . . . . 71.33 110.825 -179.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 89.0 p -60.9 -22.55 64.44 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.162 -0.472 . . . . 74.02 110.864 -179.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.43 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 0.6 OUTLIER -60.47 -44.49 95.84 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.125 -0.489 . . . . 74.54 110.895 -179.99 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.95 -51.05 69.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.244 -0.435 . . . . 73.13 110.944 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.7 -36.79 85.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.175 -0.466 . . . . 71.12 111.096 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.469 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 1.1 tttp -69.5 -49.16 57.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.191 -0.459 . . . . 74.43 110.869 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.43 ' HG ' ' O ' ' A' ' 35' ' ' LEU . 2.1 mt -61.84 -35.62 78.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.251 -0.431 . . . . 74.44 110.909 179.968 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.74 -45.92 88.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.187 -0.461 . . . . 74.2 110.891 179.799 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.469 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 3.5 pt-20 -62.81 -32.43 73.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.26 -0.427 . . . . 75.11 110.841 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.5 ttt -68.05 -34.25 76.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.18 -0.464 . . . . 63.43 110.868 -179.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.408 ' HG2' ' O ' ' A' ' 39' ' ' LEU . 2.6 mm100 -57.26 -39.22 75.19 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.265 -0.425 . . . . 75.32 110.983 -179.961 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.4 mmtt -68.78 -28.76 67.07 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.14 -0.482 . . . . 75.11 110.912 179.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -70.59 -43.84 68.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 73.32 110.881 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -82.05 -34.92 29.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.157 -0.474 . . . . 70.43 110.873 -179.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 102.65 -8.36 54.54 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.785 -0.722 . . . . 64.42 112.575 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.87 136.43 90.29 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.665 0.745 . . . . 74.31 110.874 -179.916 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.69 -51.8 0.37 Allowed 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.715 2.277 . . . . 74.5 112.369 179.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -51.11 108.25 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.219 -0.446 . . . . 72.24 111.102 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 7.4 p -96.24 156.62 16.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.119 -0.492 . . . . 73.25 111.16 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 58.76 20.22 46.57 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.783 -0.722 . . . . 64.24 112.441 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 28.4 mmt -104.99 142.76 34.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.856 0.36 . . . . 75.23 110.805 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.414 ' HA ' ' HB ' ' A' ' 58' ' ' VAL . 32.4 tp -161.9 77.91 0.52 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.194 -0.457 . . . . 74.32 110.925 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -179.04 -29.8 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.198 -0.456 . . . . 61.31 110.869 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 26.7 t -91.45 -98.55 0.12 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.206 -0.452 . . . . 75.25 110.842 -179.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 11.1 tpt180 -84.8 -31.08 24.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.123 -0.49 . . . . 74.13 110.823 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.414 ' HB ' ' HA ' ' A' ' 54' ' ' LEU . 88.9 t -63.94 -43.27 97.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.158 -0.473 . . . . 72.2 111.159 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -69.05 -30.83 47.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.12 -0.491 . . . . 75.2 111.188 179.921 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.52 -43.73 93.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.18 -0.464 . . . . 73.45 110.904 179.936 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -76.18 -29.82 19.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.092 -0.504 . . . . 74.52 111.123 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 10.1 mmm -68.91 -26.64 65.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.454 . . . . 74.01 110.84 179.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -100.07 -24.99 14.45 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.239 -0.437 . . . . 45.15 110.909 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 6.6 mtmp? -85.27 152.6 58.42 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.533 0.682 . . . . 75.32 110.929 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 152.45 69.35 Favored 'Trans proline' 0 N--CA 1.466 -0.138 0 C-N-CA 122.76 2.307 . . . . 72.11 112.303 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 2.1 ttm180 -147.99 -83.69 0.11 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.201 -0.454 . . . . 73.22 110.853 -179.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -145.72 156.57 43.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.184 -0.462 . . . . 72.31 110.882 -179.933 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.551 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -94.98 9.81 70.29 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.704 -0.76 . . . . 64.23 112.51 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -100.33 135.38 20.28 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.574 0.702 . . . . 74.23 111.157 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . 0.4 ' HB2' ' O ' ' A' ' 23' ' ' TYR . 53.1 Cg_endo -69.77 159.81 52.0 Favored 'Trans proline' 0 N--CA 1.465 -0.196 0 C-N-CA 122.709 2.273 . . . . 63.44 112.369 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -94.37 6.66 48.05 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.272 -0.422 . . . . 74.45 110.862 179.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -156.68 145.77 11.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.159 -0.473 . . . . 73.52 111.137 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -130.86 170.4 14.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.455 . . . . 73.13 111.149 179.822 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -173.53 172.94 3.55 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.288 -0.415 . . . . 74.13 110.845 -179.901 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER 65.15 150.96 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.108 -0.496 . . . . 71.51 110.92 -179.908 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 30.2 m 63.01 109.96 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.151 -0.477 . . . . 74.2 110.912 -179.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -62.19 92.93 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.145 -0.48 . . . . 70.34 110.912 -179.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -50.38 157.8 1.15 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.717 0.77 . . . . 71.24 110.888 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.69 -177.82 2.03 Favored 'Trans proline' 0 C--N 1.343 0.239 0 C-N-CA 122.655 2.237 . . . . 73.34 112.363 180.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -86.92 146.42 26.17 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.218 -0.446 . . . . 74.43 110.892 179.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 6.5 m 63.63 94.78 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.671 0.748 . . . . 70.4 110.847 -179.798 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 -7.48 21.18 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.707 2.271 . . . . 72.25 112.363 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 9.7 mtpt -117.17 148.79 41.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.229 -0.441 . . . . 72.53 110.91 179.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . 0.475 ' CE2' HD23 ' A' ' 200' ' ' LEU . 39.2 m0 -47.22 109.49 0.21 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.217 -0.447 . . . . 73.31 110.884 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.0 -5.28 11.97 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.261 -0.427 . . . . 71.34 111.151 -180.0 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -61.83 164.42 6.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 73.12 110.817 -179.844 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 11.5 mmtt -70.91 -30.66 67.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.056 -0.52 . . . . 71.12 110.953 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.421 ' HA ' ' O ' ' A' ' 123' ' ' HIS . 0.3 OUTLIER -154.02 144.92 14.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.258 -0.428 . . . . 74.14 111.092 179.879 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 5.5 t -130.64 137.51 55.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.206 -0.452 . . . . 72.25 111.165 179.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 3.5 p -117.71 167.97 10.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 75.51 111.151 -179.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.436 ' O ' ' CG2' ' A' ' 127' ' ' VAL . 3.7 p90 -150.05 146.58 27.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.251 -0.431 . . . . 70.51 110.93 -179.956 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 5.6 ttt-85 -149.43 139.75 22.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.113 -0.494 . . . . 74.3 110.811 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.8 mm -74.75 134.47 29.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.144 -0.48 . . . . 72.4 111.176 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.482 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 10.7 t -90.03 -40.68 13.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.465 . . . . 74.41 111.137 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 2.5 t -139.63 167.06 22.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.21 -0.45 . . . . 64.24 110.828 -179.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 15.6 p90 -114.93 149.96 36.44 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.115 -0.493 . . . . 74.1 110.945 -179.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' THR . . . . . 0.456 ' O ' ' O ' ' A' ' 100' ' ' LEU . 0.2 OUTLIER -83.22 140.98 32.22 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.114 -0.494 . . . . 75.33 111.113 -179.973 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.33 -8.47 55.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 72.14 110.806 -179.957 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -96.82 -25.61 15.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.252 -0.431 . . . . 74.13 110.818 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.456 ' O ' ' O ' ' A' ' 97' ' ' THR . 0.8 OUTLIER -135.84 153.44 77.18 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.632 0.73 . . . . 72.52 110.9 -179.944 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . 0.42 ' HB2' HG21 ' A' ' 103' ' ' ILE . 53.4 Cg_endo -69.79 151.12 68.81 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.666 2.244 . . . . 73.11 112.361 179.919 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 5.2 t-160 -53.96 -25.72 22.16 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.234 -0.439 . . . . 74.11 110.868 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.42 HG21 ' HB2' ' A' ' 101' ' ' PRO . 15.1 tt -75.57 -38.33 38.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.212 -0.449 . . . . 74.02 111.15 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 3.1 m -69.2 -39.49 78.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.147 -0.479 . . . . 54.24 111.119 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 92.9 t -72.93 -45.41 55.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.214 -0.448 . . . . 73.13 111.143 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.584 ' O ' HG22 ' A' ' 109' ' ' VAL . 49.8 t0 -61.5 -44.55 96.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.13 -0.486 . . . . 63.44 110.92 179.94 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 1.7 ptm180 -69.93 -33.55 72.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.171 -0.468 . . . . 75.02 110.854 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.567 ' HB3' ' HD2' ' A' ' 188' ' ' PHE . 0.0 OUTLIER -60.64 -49.07 79.02 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.15 -0.477 . . . . 75.05 110.954 -179.97 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.584 HG22 ' O ' ' A' ' 106' ' ' ASP . 1.4 m -55.61 -42.2 67.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.199 -0.455 . . . . 72.31 111.132 179.791 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.472 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 34.9 t -70.19 -34.16 72.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.157 -0.474 . . . . 72.14 110.889 -179.854 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.56 -33.36 74.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.091 -0.504 . . . . 74.35 110.842 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -95.09 -40.9 9.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.26 -0.427 . . . . 74.32 111.085 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.65 -33.12 75.16 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.254 -0.43 . . . . 74.11 110.914 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 29.6 t-20 -64.83 -40.95 96.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.177 -0.465 . . . . 75.15 110.861 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.8 -34.62 69.83 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.158 -0.473 . . . . 74.0 110.895 179.953 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 9.1 m95 -66.73 -52.36 45.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.186 -0.461 . . . . 75.23 110.887 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . 0.459 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -59.96 -37.39 92.59 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.745 -0.74 . . . . 73.44 112.485 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.4 mmpt? -61.82 -16.86 53.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.777 0.322 . . . . 74.42 110.91 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.454 ' HG2' HG12 ' A' ' 231' ' ' ILE . 0.4 OUTLIER -101.01 13.27 35.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.249 -0.432 . . . . 75.55 110.885 179.96 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.459 ' CG1' ' HA2' ' A' ' 117' ' ' GLY . 2.2 pt -147.16 146.39 25.4 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.641 0.734 . . . . 71.34 111.156 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.72 6.22 1.38 Allowed 'Trans proline' 0 C--O 1.232 0.225 0 C-N-CA 122.809 2.339 . . . . 75.35 112.318 179.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.41 ' HB3' ' H ' ' A' ' 123' ' ' HIS . 4.9 mt -62.52 -156.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.223 -0.444 . . . . 73.22 110.963 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.421 ' O ' ' HA ' ' A' ' 88' ' ' VAL . 3.8 t60 -158.67 127.37 5.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.223 -0.444 . . . . 74.12 110.862 179.851 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 11.5 m-30 -110.49 142.85 41.7 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.191 -0.459 . . . . 75.54 110.907 -179.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.96 140.17 50.12 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.162 -0.472 . . . . 75.14 110.944 -179.968 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.79 142.18 32.83 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.228 -0.442 . . . . 74.04 110.868 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . 0.436 ' CG2' ' O ' ' A' ' 91' ' ' TYR . 30.3 m -103.23 140.33 21.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.189 -0.459 . . . . 50.13 111.131 179.852 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -156.41 -27.54 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.205 -0.452 . . . . 74.43 111.129 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -135.35 109.2 8.1 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.174 -0.467 . . . . 73.32 110.939 179.994 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.97 -158.52 14.83 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.757 -0.735 . . . . 62.11 112.498 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.9 156.29 17.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.8 0.333 . . . . 71.11 111.13 -179.841 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -111.59 165.46 11.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.172 -0.467 . . . . 72.32 111.096 179.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -66.38 -62.58 1.39 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.23 -0.441 . . . . 75.41 110.907 179.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 4.5 mp -82.72 142.55 13.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.112 -0.494 . . . . 71.04 111.148 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' MET . . . . . 0.482 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 27.9 mmt -113.14 119.25 37.18 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.172 -0.467 . . . . 72.43 110.843 179.861 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -105.61 89.91 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.191 -0.459 . . . . 70.04 111.147 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -129.93 167.92 21.5 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.771 -0.728 . . . . 63.34 112.501 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 32.7 m-85 -104.89 149.96 25.26 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.828 0.347 . . . . 74.01 110.848 -179.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . 169.59 165.93 0.05 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.158 -0.473 . . . . 71.21 111.08 179.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 4.6 ptt85 -109.45 174.27 5.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.227 -0.442 . . . . 72.34 110.908 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . 0.407 ' H ' ' HA ' ' A' ' 149' ' ' PHE . . . -55.03 -16.68 8.48 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.695 -0.764 . . . . 74.24 112.528 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -91.45 13.13 18.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.817 0.342 . . . . 75.03 111.115 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 4.1 p80 -80.52 -0.99 39.98 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.199 -0.455 . . . . 73.45 110.911 179.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 107.3 45.15 1.18 Allowed Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.719 -0.753 . . . . 60.43 112.408 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 39.9 p-10 -146.05 168.82 20.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.843 0.354 . . . . 72.14 110.877 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.0 164.96 9.62 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.142 -0.481 . . . . 64.54 110.881 -179.744 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 64.73 132.37 0.03 OUTLIER Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.65 0.738 . . . . 73.4 110.916 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.67 151.02 69.47 Favored 'Trans proline' 0 C--O 1.231 0.125 0 C-N-CA 122.715 2.276 . . . . 74.53 112.342 179.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 149' ' ' PHE . . . . . 0.468 ' C ' ' H ' ' A' ' 151' ' ' GLY . 7.0 p90 -53.94 -41.94 68.28 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.227 -0.442 . . . . 70.0 110.906 179.966 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 76.69 -22.69 0.27 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.118 -0.492 . . . . 72.24 110.861 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . 0.468 ' H ' ' C ' ' A' ' 149' ' ' PHE . . . 74.8 -149.55 39.94 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.812 -0.709 . . . . 75.42 112.472 -179.914 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.71 142.35 47.89 Favored 'Trans proline' 0 C--N 1.341 0.137 0 C-N-CA 122.666 2.244 . . . . 75.11 112.349 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . 0.448 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 104.34 -139.45 14.58 Favored Glycine 0 N--CA 1.453 -0.197 0 C-N-CA 120.669 -0.777 . . . . 70.32 112.456 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 154' ' ' ASN . . . . . 0.448 ' C ' ' O ' ' A' ' 153' ' ' GLY . 4.0 p30 -34.77 140.93 0.07 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.963 0.411 . . . . 74.45 110.895 -179.871 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 155' ' ' THR . . . . . 0.41 ' CB ' ' O ' ' A' ' 154' ' ' ASN . 1.6 m 78.21 107.19 0.07 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.136 -0.484 . . . . 63.14 111.141 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . 0.454 HD11 HG13 ' A' ' 186' ' ' ILE . 0.8 OUTLIER -93.8 -54.69 3.52 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.211 -0.449 . . . . 75.02 110.921 179.921 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . 0.551 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -158.56 148.0 19.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.177 -0.465 . . . . 73.44 111.069 179.843 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 26.5 p-80 -109.67 122.47 47.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.21 -0.45 . . . . 74.34 110.824 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -109.59 160.63 16.09 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.221 -0.445 . . . . 74.42 111.13 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 11.8 m-85 -118.4 156.29 29.23 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.208 -0.451 . . . . 75.31 110.865 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -82.85 165.29 42.42 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.543 0.687 . . . . 71.14 111.127 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.89 67.69 1.8 Allowed 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.668 2.246 . . . . 74.44 112.345 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -127.82 107.11 0.84 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.733 -0.746 . . . . 72.32 112.527 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 72.83 174.39 0.29 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.888 0.375 . . . . 73.1 111.119 -179.886 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -50.06 -57.59 9.82 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.776 -0.725 . . . . 74.03 112.433 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -60.48 -18.03 48.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.895 0.378 . . . . 75.02 110.964 -179.937 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -68.87 146.8 45.5 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.766 -0.731 . . . . 43.43 112.55 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 81.33 11.78 82.94 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.751 -0.738 . . . . 74.31 112.487 -179.871 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 57.6 m-20 -79.8 148.83 31.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.848 0.356 . . . . 63.41 110.802 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.26 130.41 55.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.148 -0.478 . . . . 74.21 111.084 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 20.6 m170 -126.86 132.4 50.96 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.218 -0.446 . . . . 72.53 110.911 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 32.2 m-85 -113.7 139.56 48.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.268 -0.424 . . . . 71.44 110.841 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 55.0 t0 -71.63 100.69 2.35 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.129 -0.487 . . . . 74.11 110.809 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.71 -16.73 11.86 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.223 -0.444 . . . . 74.45 110.937 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -77.99 -16.26 58.27 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.104 -0.498 . . . . 73.32 110.911 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -85.05 -174.39 5.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.157 -0.474 . . . . 71.41 110.864 -179.873 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 6.4 mtt85 -112.33 115.14 28.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.156 -0.474 . . . . 74.32 110.85 -179.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 58.9 m95 -115.97 138.5 51.14 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.153 -0.476 . . . . 74.32 110.882 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 7.3 t -176.87 163.57 2.25 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.241 -0.436 . . . . 74.13 111.175 -179.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -125.06 -68.71 0.83 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.277 -0.419 . . . . 61.52 110.84 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -65.14 -11.68 52.59 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.757 -0.735 . . . . 62.41 112.479 -179.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 182' ' ' SER . . . . . 0.429 ' O ' ' C ' ' A' ' 183' ' ' SER . 0.3 OUTLIER -95.38 -24.24 16.8 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.845 0.355 . . . . 74.0 110.84 -179.698 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 183' ' ' SER . . . . . 0.429 ' C ' ' O ' ' A' ' 182' ' ' SER . 89.9 p 34.97 58.87 0.73 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.086 -0.506 . . . . 64.12 110.869 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 2.2 tp -116.73 -33.67 4.74 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.105 -0.498 . . . . 74.43 110.887 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -119.58 -138.41 5.71 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.754 -0.736 . . . . 74.22 112.489 179.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 186' ' ' ILE . . . . . 0.454 HG13 HD11 ' A' ' 156' ' ' LEU . 6.1 mm -79.51 98.75 3.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.897 0.379 . . . . 73.22 111.142 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -46.65 127.25 9.37 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.132 -0.486 . . . . 71.31 110.886 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 188' ' ' PHE . . . . . 0.567 ' HD2' ' HB3' ' A' ' 108' ' ' LEU . 1.2 t80 -60.66 -37.39 81.42 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.217 -0.447 . . . . 75.45 110.93 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.7 -47.89 70.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.129 -0.487 . . . . 60.14 110.933 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 48.8 t80 -69.7 -38.57 77.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.464 . . . . 74.22 110.948 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -72.88 -35.91 67.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.085 -0.507 . . . . 61.32 111.068 179.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 192' ' ' ALA . . . . . 0.491 ' O ' ' HB2' ' A' ' 196' ' ' LEU . . . -57.26 -45.23 84.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.194 -0.457 . . . . 52.32 111.057 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.39 -41.94 86.0 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.159 -0.473 . . . . 72.43 111.167 -179.883 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 4.9 t60 -72.71 -45.56 58.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.199 -0.455 . . . . 71.44 110.853 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -68.02 -47.96 67.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.202 -0.454 . . . . 71.01 111.079 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 196' ' ' LEU . . . . . 0.502 ' N ' HD23 ' A' ' 196' ' ' LEU . 4.4 mm? -63.71 -37.32 86.92 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.199 -0.455 . . . . 74.52 110.954 -179.929 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -61.97 -26.46 67.33 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.783 -0.723 . . . . 62.43 112.541 179.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 198' ' ' HIS . . . . . . . . . . . . . 6.1 m-70 -68.83 -42.87 76.61 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.753 0.311 . . . . 75.21 110.84 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.18 -27.59 65.82 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.452 . . . . 73.13 110.888 -179.765 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 200' ' ' LEU . . . . . 0.475 HD23 ' CE2' ' A' ' 84' ' ' TRP . 0.6 OUTLIER -84.78 0.17 51.66 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.041 -0.527 . . . . 75.12 110.938 179.973 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 88.36 -9.37 75.65 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.697 -0.764 . . . . 50.41 112.444 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 202' ' ' MET . . . . . 0.461 ' CE ' ' HB ' ' A' ' 234' ' ' ILE . 0.4 OUTLIER -60.33 127.14 30.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.838 0.352 . . . . 71.04 110.886 -179.995 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -101.03 178.86 28.44 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.781 -0.724 . . . . 64.44 112.486 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 18.4 m-70 -68.94 159.65 32.29 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.821 0.343 . . . . 74.32 110.86 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -122.25 157.36 31.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.204 -0.453 . . . . 72.42 110.807 -179.764 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -87.88 -4.43 58.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.084 -0.507 . . . . 72.22 110.863 -179.827 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.44 137.49 83.68 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.681 0.753 . . . . 65.11 110.871 179.943 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 -6.68 19.17 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.694 2.263 . . . . 74.53 112.348 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 -127.61 33.48 4.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.213 -0.449 . . . . 63.52 110.896 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 210' ' ' ALA . . . . . 0.496 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.14 145.99 26.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.156 -0.475 . . . . 64.4 111.104 179.851 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -73.47 -26.86 22.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.213 -0.449 . . . . 75.23 111.2 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 16.3 tpp -94.76 6.94 47.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.14 -0.482 . . . . 75.22 110.846 179.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 213' ' ' TYR . . . . . 0.408 ' HB2' ' O ' ' A' ' 210' ' ' ALA . 0.1 OUTLIER -56.2 127.32 70.21 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.703 0.763 . . . . 73.43 110.929 -179.857 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.77 -29.57 23.63 Favored 'Trans proline' 0 C--O 1.231 0.159 0 C-N-CA 122.687 2.258 . . . . 63.01 112.357 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 60.4 p -84.42 62.23 7.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.214 -0.448 . . . . 74.24 111.205 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 -42.43 145.88 0.38 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.247 -0.433 . . . . 74.42 110.906 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -63.96 169.96 20.51 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.732 -0.747 . . . . 74.22 112.563 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 26.5 t30 -54.59 -74.03 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.895 0.378 . . . . 64.22 110.88 -179.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . -83.7 -142.89 5.22 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.791 -0.719 . . . . 73.55 112.512 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 220' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -120.12 153.58 55.47 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.645 0.736 . . . . 73.41 110.873 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.73 120.51 7.29 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.691 2.26 . . . . 74.21 112.378 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -54.44 -44.93 72.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 75.43 110.855 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -123.26 -36.04 2.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.238 -0.437 . . . . 70.33 110.86 -179.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER 65.92 129.58 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.166 -0.47 . . . . 71.11 110.901 -179.952 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -143.6 159.24 42.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.153 -0.476 . . . . 65.02 110.964 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . 0.4 HD13 ' HG2' ' A' ' 119' ' ' GLU . 29.9 mt -65.5 148.79 51.14 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.286 -0.415 . . . . 62.53 110.924 179.93 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 227' ' ' SER . . . . . 0.496 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 1.8 t -87.65 151.71 22.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.216 -0.447 . . . . 74.21 110.83 -179.922 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.54 -63.0 1.15 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.115 -0.493 . . . . 74.54 110.89 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -55.7 -27.47 50.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.163 -0.471 . . . . 74.2 110.842 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -70.58 -49.41 48.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.279 -0.418 . . . . 74.23 110.885 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 231' ' ' ILE . . . . . 0.454 HG12 ' HG2' ' A' ' 119' ' ' GLU . 9.5 mt -69.34 -45.03 79.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 73.41 111.101 179.972 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.21 -33.18 67.25 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.238 -0.437 . . . . 73.32 110.867 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -63.12 -49.49 71.09 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.81 -0.709 . . . . 65.45 112.467 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 234' ' ' ILE . . . . . 0.461 ' HB ' ' CE ' ' A' ' 202' ' ' MET . 6.8 tt -72.59 -29.1 29.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.814 0.34 . . . . 74.41 111.16 180.0 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -60.23 -28.51 68.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.159 -0.473 . . . . 71.13 110.944 179.945 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 236' ' ' LYS . . . . . 0.452 ' HD3' ' N ' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.67 -27.3 60.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.241 -0.436 . . . . 74.41 110.92 179.915 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 237' ' ' LEU . . . . . 0.452 ' N ' ' HD3' ' A' ' 236' ' ' LYS . 8.2 tt -97.48 -24.59 15.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.213 -0.449 . . . . 75.41 110.936 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 238' ' ' TYR . . . . . 0.44 ' CD1' HG13 ' A' ' 234' ' ' ILE . 3.8 m-85 -92.31 -35.38 13.78 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.452 . . . . 54.42 110.925 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -152.77 -117.31 0.69 Allowed Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.763 -0.732 . . . . 72.22 112.475 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -83.65 143.53 30.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.818 0.342 . . . . 75.42 110.886 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 5.9 ptm180 -78.8 -174.08 3.78 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.141 -0.482 . . . . 73.34 110.876 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 5.5 m -160.73 -43.77 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.131 -0.486 . . . . 62.43 110.778 -179.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 2.9 t30 -163.95 -171.95 2.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.216 -0.447 . . . . 72.13 110.851 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 10.1 p -98.91 -179.9 4.42 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.122 -0.49 . . . . 71.41 110.854 -179.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 30.2 ptt180 -167.72 -173.73 2.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.084 -0.507 . . . . 75.43 110.837 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 9.6 mmtm -143.97 140.2 29.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.191 -0.459 . . . . 72.11 110.847 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 15.5 tptm . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.185 -0.462 . . . . 74.13 110.87 179.856 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 302' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' -2' ' ' LEU . . . . . . . . . . . . . 2.7 tp . . . . . 0 C--O 1.231 0.087 0 CA-C-O 121.649 0.738 . . . . 73.02 110.908 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' -1' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.85 84.41 0.67 Allowed 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.724 2.283 . . . . 73.21 112.305 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 0' ' ' LEU . . . . . 0.482 ' N ' ' HD2' ' A' ' 1' ' ' PRO . 0.2 OUTLIER -59.45 -60.39 10.72 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-O 121.551 0.691 . . . . 75.23 110.904 179.995 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . 0.482 ' HD2' ' N ' ' A' ' 0' ' ' LEU . 53.5 Cg_endo -69.72 -173.11 0.65 Allowed 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.685 2.257 . . . . 64.24 112.354 179.85 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -113.79 119.37 37.12 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.276 -0.42 . . . . 62.24 110.897 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -95.41 -22.57 17.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.275 -0.42 . . . . 74.01 110.887 -179.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.39 -33.95 66.25 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.115 -0.493 . . . . 71.4 111.109 179.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -55.8 -29.66 55.17 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.799 -0.715 . . . . 62.21 112.512 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -109.0 -8.62 27.42 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.741 -0.742 . . . . 54.42 112.497 -179.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 39.5 mtt -60.81 164.25 4.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.777 0.322 . . . . 72.23 110.872 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -81.29 168.61 18.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.203 -0.453 . . . . 73.24 110.858 -179.816 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -58.03 -31.86 67.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.125 -0.489 . . . . 73.44 110.927 179.936 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.9 mp -60.45 -42.67 96.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.131 -0.486 . . . . 72.33 110.945 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 69.3 mm-40 -61.71 -43.39 98.95 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.163 -0.472 . . . . 72.14 110.955 179.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 15.2 t-105 -73.15 -30.93 63.94 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.185 -0.461 . . . . 71.22 110.958 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -73.27 -35.26 66.15 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.236 -0.438 . . . . 72.51 110.825 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.98 -39.26 94.18 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.205 -0.452 . . . . 74.32 110.864 -179.876 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.22 -35.13 69.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.174 -0.466 . . . . 74.22 111.069 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.31 -40.07 85.97 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.251 -0.431 . . . . 73.12 110.896 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -77.18 -31.71 55.61 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.191 -0.459 . . . . 72.4 110.873 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -62.73 -36.16 82.09 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.185 -0.461 . . . . 75.11 110.926 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -71.38 -21.04 62.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.124 -0.489 . . . . 75.43 110.896 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 4.4 ptmt -74.8 -29.81 61.22 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.206 -0.452 . . . . 75.45 110.928 179.829 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.6 ptp85 -86.59 -28.03 23.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.205 -0.452 . . . . 74.22 110.905 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 13.0 m-85 -68.82 -10.66 58.05 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.157 -0.474 . . . . 75.2 110.814 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -120.34 -61.52 1.57 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.197 -0.456 . . . . 74.4 110.92 -179.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 11.9 mt -161.49 -86.74 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.135 -0.484 . . . . 75.43 110.906 179.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -178.93 89.84 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.228 -0.442 . . . . 71.41 110.989 -179.989 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -116.36 90.41 3.33 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.158 -0.473 . . . . 74.25 110.809 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 11.6 p -85.37 -33.5 21.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.218 -0.446 . . . . 62.15 110.801 -179.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.4 pm0 -75.61 -13.04 60.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.213 -0.449 . . . . 74.51 110.913 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 68.0 m -76.96 -17.5 58.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.187 -0.46 . . . . 72.53 111.093 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.7 mtmp? -53.59 101.91 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.243 -0.435 . . . . 74.12 110.856 179.857 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -171.11 151.97 3.35 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.251 -0.431 . . . . 74.52 110.888 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.43 -20.0 66.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.146 -0.479 . . . . 71.02 111.168 179.835 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -85.04 -48.89 8.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.183 -0.462 . . . . 71.33 110.932 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -75.12 -21.36 58.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.131 -0.486 . . . . 74.02 110.837 -179.86 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.3 tt -63.33 -44.51 94.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.209 -0.451 . . . . 74.54 110.982 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.09 -51.22 65.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.184 -0.462 . . . . 73.13 110.872 179.935 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.5 -51.04 68.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.076 -0.511 . . . . 71.12 111.138 179.898 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.481 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 5.9 tttp -59.94 -49.35 78.03 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.222 -0.445 . . . . 74.43 110.891 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.421 ' O ' ' HG2' ' A' ' 43' ' ' GLN . 0.1 OUTLIER -58.04 -36.4 72.69 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.261 -0.427 . . . . 74.44 110.909 179.922 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.2 tttm -58.99 -45.7 90.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.151 -0.477 . . . . 74.2 110.847 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.481 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 3.2 pt-20 -60.58 -32.62 71.72 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.226 -0.443 . . . . 75.11 110.905 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 7.5 ttt -68.37 -33.99 75.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.197 -0.456 . . . . 63.43 110.892 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.425 ' HG3' ' HA ' ' A' ' 51' ' ' THR . 1.3 mm-40 -61.33 -39.66 91.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.242 -0.435 . . . . 75.32 110.964 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.2 mmpt? -72.39 -32.97 66.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 75.11 110.862 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 56.3 t80 -70.63 -40.68 72.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.181 -0.463 . . . . 73.32 110.839 180.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -82.25 -35.16 28.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.185 -0.462 . . . . 70.43 110.819 -179.829 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 104.05 -10.17 51.34 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.784 -0.722 . . . . 64.42 112.489 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.11 138.13 91.24 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.518 0.675 . . . . 74.31 110.936 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 -53.55 0.26 Allowed 'Trans proline' 0 C--O 1.231 0.151 0 C-N-CA 122.713 2.276 . . . . 74.5 112.35 179.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -51.9 108.25 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 72.24 111.196 179.934 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.425 ' HA ' ' HG3' ' A' ' 43' ' ' GLN . 39.8 p -113.96 151.5 32.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.155 -0.475 . . . . 73.25 111.149 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 76.46 -0.61 63.84 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.756 -0.735 . . . . 64.24 112.528 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.9 mtt -135.22 161.08 36.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.836 0.35 . . . . 75.23 110.892 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.414 ' HA ' ' HB ' ' A' ' 58' ' ' VAL . 2.8 pp -156.78 128.63 7.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.271 -0.422 . . . . 74.32 110.882 -179.945 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.4 t30 173.01 -28.67 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.165 -0.471 . . . . 61.31 110.836 179.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 23.1 p -96.85 -87.09 0.32 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.216 -0.447 . . . . 75.25 110.856 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -84.49 -34.77 23.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.187 -0.46 . . . . 74.13 110.864 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.512 ' O ' HG13 ' A' ' 61' ' ' ILE . 14.1 t -59.94 -46.92 93.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.224 -0.444 . . . . 72.2 111.143 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.0 tp -75.61 -32.14 24.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.165 -0.471 . . . . 75.2 111.099 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -59.92 -44.24 94.42 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.208 -0.451 . . . . 73.45 110.884 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.512 HG13 ' O ' ' A' ' 58' ' ' VAL . 1.7 pp -67.94 -29.52 45.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.225 -0.443 . . . . 74.52 111.098 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 4.7 mmt -61.68 -39.16 90.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.192 -0.458 . . . . 74.01 110.806 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -90.26 -26.29 20.13 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.275 -0.421 . . . . 45.15 110.935 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 4.1 mtmp? -85.21 133.95 41.73 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.573 0.701 . . . . 75.32 110.864 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.7 149.85 67.83 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.69 2.26 . . . . 72.11 112.368 179.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.31 -78.63 0.2 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.198 -0.455 . . . . 73.22 110.875 -179.934 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 16.0 p -145.29 141.51 28.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.186 -0.461 . . . . 72.31 110.852 -179.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.573 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -90.32 17.2 55.16 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.768 -0.729 . . . . 64.23 112.518 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -110.52 141.19 23.48 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.556 0.693 . . . . 74.23 111.154 -179.955 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 -179.86 3.2 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.615 2.21 . . . . 63.44 112.367 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -139.33 27.33 2.32 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.211 -0.449 . . . . 74.45 110.902 179.917 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -136.56 130.07 46.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.207 -0.451 . . . . 73.52 111.128 -179.943 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -130.7 170.35 14.44 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.206 -0.452 . . . . 73.13 111.093 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -161.24 172.73 16.15 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.152 -0.476 . . . . 74.13 110.851 -179.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -51.99 137.65 26.6 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.162 -0.472 . . . . 71.51 110.961 -179.895 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 179.79 179.3 0.52 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.172 -0.467 . . . . 74.2 110.94 -179.78 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -77.25 58.58 1.64 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.145 -0.48 . . . . 70.34 110.956 179.938 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -104.99 160.73 24.98 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.704 0.764 . . . . 71.24 110.885 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.81 -174.89 1.0 Allowed 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.733 2.289 . . . . 73.34 112.284 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 8.4 m-80 -128.29 97.3 4.7 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.17 -0.468 . . . . 74.43 110.925 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -179.91 121.99 0.22 Allowed Pre-proline 0 C--N 1.33 -0.258 0 CA-C-O 121.597 0.713 . . . . 70.4 110.854 -179.81 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.79 -47.14 0.98 Allowed 'Trans proline' 0 C--O 1.232 0.213 0 C-N-CA 122.659 2.24 . . . . 72.25 112.362 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.07 -178.47 5.47 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.237 -0.438 . . . . 72.53 110.898 179.865 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . 0.506 ' CE2' HD21 ' A' ' 200' ' ' LEU . 38.1 m0 -59.11 109.77 0.92 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 73.31 110.958 179.926 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 12.0 t -104.49 -14.87 15.53 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.289 -0.414 . . . . 71.34 111.092 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -56.76 152.45 12.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.261 -0.427 . . . . 73.12 110.87 -179.867 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.95 -30.58 71.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.163 -0.471 . . . . 71.12 110.875 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -156.94 144.12 10.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.28 -0.418 . . . . 74.14 111.122 179.86 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 64.7 t -124.36 138.99 52.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.192 -0.458 . . . . 72.25 111.131 179.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 1.1 p -115.83 151.14 35.81 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.159 -0.473 . . . . 75.51 111.127 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 5.4 p90 -133.11 146.55 51.71 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.218 -0.447 . . . . 70.51 110.939 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -148.29 138.17 22.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.102 -0.499 . . . . 74.3 110.832 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 11.7 mm -77.59 135.18 26.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.167 -0.47 . . . . 72.4 111.141 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.431 ' HB ' ' HA3' ' A' ' 137' ' ' GLY . 15.3 t -91.37 -40.5 12.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.173 -0.467 . . . . 74.41 111.14 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 3.8 t -141.44 169.44 17.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.145 -0.479 . . . . 64.24 110.859 -179.755 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 12.2 p90 -117.27 150.34 38.95 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.177 -0.465 . . . . 74.1 110.94 -179.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' THR . . . . . 0.454 ' O ' ' O ' ' A' ' 100' ' ' LEU . 0.2 OUTLIER -82.87 141.06 32.53 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.145 -0.48 . . . . 75.33 111.17 -179.986 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 2.0 ptt180 -72.42 -8.07 53.09 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.207 -0.451 . . . . 72.14 110.852 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -96.63 -25.94 15.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.218 -0.446 . . . . 74.13 110.801 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.454 ' O ' ' O ' ' A' ' 97' ' ' THR . 0.7 OUTLIER -135.54 152.67 76.78 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.675 0.75 . . . . 72.52 110.902 -179.974 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . 0.418 ' HB2' HG22 ' A' ' 103' ' ' ILE . 54.1 Cg_endo -69.69 151.04 69.41 Favored 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.706 2.271 . . . . 73.11 112.336 179.915 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 6.0 t-160 -52.91 -25.71 12.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.191 -0.459 . . . . 74.11 110.884 179.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.418 HG22 ' HB2' ' A' ' 101' ' ' PRO . 13.9 tt -76.74 -39.14 31.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.223 -0.444 . . . . 74.02 111.153 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 3.4 m -69.07 -40.06 78.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 54.24 111.179 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 90.7 t -72.99 -45.35 55.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.213 -0.449 . . . . 73.13 111.137 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.56 ' O ' HG22 ' A' ' 109' ' ' VAL . 48.1 t0 -61.3 -45.11 95.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.164 -0.471 . . . . 63.44 110.835 179.873 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 4.7 ptm85 -69.71 -33.31 72.32 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.196 -0.457 . . . . 75.02 110.902 -179.873 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.526 ' HB3' ' HD2' ' A' ' 188' ' ' PHE . 0.0 OUTLIER -60.38 -48.72 80.53 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.241 -0.436 . . . . 75.05 110.911 179.957 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.56 HG22 ' O ' ' A' ' 106' ' ' ASP . 1.2 m -55.44 -41.89 64.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.173 -0.467 . . . . 72.31 111.104 179.824 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.471 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 47.2 t -70.0 -34.35 73.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.204 -0.453 . . . . 72.14 110.838 -179.787 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.51 -33.4 74.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.186 -0.461 . . . . 74.35 110.906 179.939 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -93.27 -40.61 10.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.206 -0.452 . . . . 74.32 111.061 179.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.85 -33.35 75.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.232 -0.44 . . . . 74.11 110.928 -179.937 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -67.31 -40.99 86.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.233 -0.44 . . . . 75.15 110.882 179.88 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' MET . . . . . 0.427 ' HA ' ' HE3' ' A' ' 118' ' ' LYS . 0.0 OUTLIER -57.93 -34.35 69.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.184 -0.462 . . . . 74.0 110.921 179.89 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' TRP . . . . . 0.456 ' O ' HG12 ' A' ' 120' ' ' ILE . 6.5 m95 -64.84 -49.6 69.95 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.172 -0.467 . . . . 75.23 110.938 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . 0.601 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -73.02 -24.92 74.96 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.801 -0.714 . . . . 73.44 112.468 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . 0.427 ' HE3' ' HA ' ' A' ' 115' ' ' MET . 0.3 OUTLIER -64.52 -13.95 54.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.736 0.303 . . . . 74.42 110.921 -179.985 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.449 ' HG3' HG12 ' A' ' 231' ' ' ILE . 1.7 mm-40 -112.61 13.91 20.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.181 -0.463 . . . . 75.55 110.953 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.601 ' CG1' ' HA2' ' A' ' 117' ' ' GLY . 5.0 pt -148.25 150.08 33.78 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.679 0.752 . . . . 71.34 111.161 179.975 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 24.51 0.18 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.658 2.239 . . . . 75.35 112.377 179.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.529 ' H ' ' C ' ' A' ' 120' ' ' ILE . 8.3 mt -70.95 -155.03 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.107 -0.497 . . . . 73.22 110.92 179.938 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.463 ' H ' ' HB3' ' A' ' 122' ' ' LEU . 3.5 t-160 -172.53 121.51 0.42 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.136 -0.484 . . . . 74.12 110.871 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.9 m-85 -106.97 141.79 37.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.261 -0.427 . . . . 75.54 110.876 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.24 141.17 48.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.191 -0.459 . . . . 75.14 110.897 -179.931 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.88 140.09 35.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.153 -0.476 . . . . 74.04 110.864 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 32.7 m -103.06 138.29 27.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.205 -0.452 . . . . 50.13 111.132 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -153.47 -27.66 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.166 -0.47 . . . . 74.43 111.107 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -134.5 109.26 8.6 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.1 -0.5 . . . . 73.32 110.932 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.39 -160.5 14.05 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.737 -0.744 . . . . 62.11 112.538 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -101.83 155.64 18.01 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.829 0.347 . . . . 71.11 111.165 -179.883 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -112.22 165.28 12.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.216 -0.447 . . . . 72.32 111.061 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -73.11 -57.03 4.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 75.41 110.834 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 7.0 mm -82.5 112.79 20.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.189 -0.459 . . . . 71.04 111.102 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 2.0 mmm -96.63 116.6 29.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.115 -0.493 . . . . 72.43 110.903 179.86 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -106.21 94.64 3.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.238 -0.437 . . . . 70.04 111.096 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . 0.431 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -134.31 169.46 23.02 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.748 -0.739 . . . . 63.34 112.514 179.856 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -105.13 149.83 25.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.847 0.356 . . . . 74.01 110.844 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . 171.36 167.71 0.08 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.071 -0.513 . . . . 71.21 111.04 179.899 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.431 ' HB3' ' HB3' ' A' ' 149' ' ' PHE . 35.1 mtp180 -103.95 173.04 6.47 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.188 -0.46 . . . . 72.34 110.855 -179.883 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -57.34 -16.23 19.74 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.682 -0.77 . . . . 74.24 112.553 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -94.52 13.34 24.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.804 0.335 . . . . 75.03 111.075 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 9.2 p80 -71.49 -9.35 58.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 73.45 110.854 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 116.9 50.03 0.41 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.739 -0.743 . . . . 60.43 112.458 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -162.56 170.7 18.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.851 0.358 . . . . 72.14 110.851 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -64.11 175.86 1.15 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.129 -0.487 . . . . 64.54 110.836 -179.719 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 11.2 m-85 64.37 119.36 0.02 OUTLIER Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.634 0.731 . . . . 73.4 110.95 -179.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.69 151.76 69.55 Favored 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.702 2.268 . . . . 74.53 112.327 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 149' ' ' PHE . . . . . 0.476 ' C ' ' H ' ' A' ' 151' ' ' GLY . 8.2 p90 -53.44 -42.7 67.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 70.0 110.867 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 75.55 -22.03 0.28 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.187 -0.46 . . . . 72.24 110.888 179.994 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . 0.476 ' H ' ' C ' ' A' ' 149' ' ' PHE . . . 75.64 -156.11 47.63 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.766 -0.731 . . . . 75.42 112.486 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -69.7 142.45 48.22 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.717 2.278 . . . . 75.11 112.362 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . 0.443 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 104.52 -137.27 13.52 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.719 -0.753 . . . . 70.32 112.466 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 154' ' ' ASN . . . . . 0.443 ' C ' ' O ' ' A' ' 153' ' ' GLY . 9.7 p30 -35.03 144.38 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.981 0.419 . . . . 74.45 110.919 -179.923 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 73.49 106.75 0.07 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.178 -0.465 . . . . 63.14 111.119 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 156' ' ' LEU . . . . . 0.451 HD12 HG13 ' A' ' 186' ' ' ILE . 0.6 OUTLIER -87.87 -55.16 3.88 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.2 -0.455 . . . . 75.02 110.873 179.962 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . 0.573 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -163.68 148.24 10.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.203 -0.453 . . . . 73.44 111.162 179.764 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 23.8 p-80 -107.01 128.95 54.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.234 -0.439 . . . . 74.34 110.912 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -109.84 160.33 16.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.195 -0.457 . . . . 74.42 111.078 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 10.7 m-30 -106.59 141.66 37.52 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.231 -0.441 . . . . 75.31 110.919 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -73.85 163.48 68.08 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.57 0.7 . . . . 71.14 111.064 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -69.82 76.15 1.19 Allowed 'Trans proline' 0 C--N 1.341 0.136 0 C-N-CA 122.704 2.269 . . . . 74.44 112.31 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -127.46 100.6 0.55 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.725 -0.75 . . . . 72.32 112.445 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 1.3 p 60.21 176.83 0.09 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.856 0.36 . . . . 73.1 111.144 -179.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -52.29 -47.94 54.86 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.733 -0.746 . . . . 74.03 112.439 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.17 -19.67 55.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.884 0.373 . . . . 75.02 110.925 -179.893 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -84.71 168.88 44.15 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.768 -0.729 . . . . 43.43 112.482 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 74.6 16.79 80.0 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.711 -0.757 . . . . 74.31 112.453 -179.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -77.33 150.2 35.21 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.818 0.342 . . . . 63.41 110.896 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.67 129.97 56.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.215 -0.448 . . . . 74.21 111.079 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 28.6 m170 -131.3 132.32 44.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.229 -0.442 . . . . 72.53 110.883 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 51.4 m-85 -117.72 139.38 51.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.166 -0.47 . . . . 71.44 110.903 -179.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 59.0 t0 -71.35 98.86 1.85 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.164 -0.471 . . . . 74.11 110.88 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 1.7 pp20? -57.7 -16.33 10.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.225 -0.443 . . . . 74.45 110.859 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -78.95 -16.35 57.07 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.161 -0.472 . . . . 73.32 110.84 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 -82.11 -176.06 5.96 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.259 -0.428 . . . . 71.41 110.973 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 177' ' ' ARG . . . . . 0.401 ' HG3' ' HA3' ' A' ' 185' ' ' GLY . 4.3 ptp180 -116.82 111.86 20.31 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.219 -0.446 . . . . 74.32 110.944 -179.989 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 5.1 m95 -117.29 152.27 35.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.172 -0.467 . . . . 74.32 110.944 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 7.8 t 178.41 163.7 0.73 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.27 -0.423 . . . . 74.13 111.142 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -120.55 -75.09 0.59 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.21 -0.45 . . . . 61.52 110.892 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -56.13 -20.18 26.91 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.721 -0.752 . . . . 62.41 112.486 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 182' ' ' SER . . . . . 0.447 ' O ' ' C ' ' A' ' 183' ' ' SER . 0.4 OUTLIER -90.9 -24.7 20.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.963 0.411 . . . . 74.0 110.935 -179.802 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 183' ' ' SER . . . . . 0.447 ' C ' ' O ' ' A' ' 182' ' ' SER . 12.9 p 34.45 47.96 0.25 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.06 -0.518 . . . . 64.12 110.873 -179.806 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 3.6 tp -105.42 -33.71 8.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.102 -0.499 . . . . 74.43 110.981 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 185' ' ' GLY . . . . . 0.401 ' HA3' ' HG3' ' A' ' 177' ' ' ARG . . . -114.39 -141.82 7.79 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.763 -0.732 . . . . 74.22 112.504 179.922 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 186' ' ' ILE . . . . . 0.451 HG13 HD12 ' A' ' 156' ' ' LEU . 10.5 mm -78.82 97.58 2.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.888 0.375 . . . . 73.22 111.134 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -46.57 119.5 2.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.168 -0.469 . . . . 71.31 110.838 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 188' ' ' PHE . . . . . 0.526 ' HD2' ' HB3' ' A' ' 108' ' ' LEU . 2.4 t80 -54.19 -36.46 63.45 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.474 . . . . 75.45 110.898 179.975 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . 0.404 HD23 HD11 ' A' ' 108' ' ' LEU . 0.0 OUTLIER -67.11 -47.47 71.04 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.137 -0.483 . . . . 60.14 110.925 -179.965 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 58.3 t80 -69.07 -37.04 78.29 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.201 -0.454 . . . . 74.22 110.973 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -72.81 -35.57 67.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.085 -0.507 . . . . 61.32 111.126 179.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 192' ' ' ALA . . . . . 0.445 ' O ' ' HB2' ' A' ' 196' ' ' LEU . . . -56.73 -44.84 82.06 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.217 -0.447 . . . . 52.32 111.131 179.847 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -58.65 -41.89 87.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.168 -0.469 . . . . 72.43 111.161 -179.892 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 2.6 t60 -72.83 -40.61 65.61 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.236 -0.438 . . . . 71.44 110.8 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -73.42 -47.44 41.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.181 -0.463 . . . . 71.01 111.061 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 196' ' ' LEU . . . . . 0.495 HD22 ' N ' ' A' ' 196' ' ' LEU . 4.4 mm? -64.2 -43.42 95.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.211 -0.45 . . . . 74.52 110.942 -179.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -57.44 -28.2 59.12 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.706 -0.759 . . . . 62.43 112.473 179.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 198' ' ' HIS . . . . . . . . . . . . . 4.7 m-70 -66.5 -44.26 83.07 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.827 0.346 . . . . 75.21 110.871 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.42 -25.86 64.69 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.207 -0.451 . . . . 73.13 110.891 -179.824 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 200' ' ' LEU . . . . . 0.506 HD21 ' CE2' ' A' ' 84' ' ' TRP . 1.5 mt -82.22 -3.07 54.33 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.161 -0.472 . . . . 75.12 110.879 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 88.96 -5.64 84.36 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.807 -0.711 . . . . 50.41 112.565 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 202' ' ' MET . . . . . 0.425 ' SD ' ' CZ3' ' A' ' 116' ' ' TRP . 2.2 mtp -61.93 134.97 57.34 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.815 0.34 . . . . 71.04 110.907 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -101.17 177.11 27.32 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.787 -0.721 . . . . 64.44 112.494 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 17.9 m-70 -70.26 160.76 31.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.782 0.325 . . . . 74.32 110.868 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -121.39 151.72 39.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.194 -0.457 . . . . 72.42 110.827 -179.768 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 2.0 p -87.73 -4.63 58.89 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.178 -0.465 . . . . 72.22 110.818 -179.834 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.83 137.9 82.63 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.646 0.736 . . . . 65.11 110.791 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 -7.61 21.49 Favored 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.641 2.227 . . . . 74.53 112.311 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -126.08 29.79 5.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.26 -0.427 . . . . 63.52 110.862 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 210' ' ' ALA . . . . . 0.449 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.34 145.76 26.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.123 -0.489 . . . . 64.4 111.112 179.878 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -69.69 -28.57 37.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.185 -0.461 . . . . 75.23 111.08 -179.929 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 14.0 tpp -96.48 10.49 38.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.177 -0.465 . . . . 75.22 110.953 179.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 213' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -55.69 115.05 8.5 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.629 0.728 . . . . 73.43 110.862 -179.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.78 -18.11 37.12 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.661 2.24 . . . . 63.01 112.353 179.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -84.2 52.95 2.46 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.254 -0.43 . . . . 74.24 111.165 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -74.75 124.81 27.47 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.163 -0.471 . . . . 74.42 110.912 -179.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . 163.08 103.03 0.17 Allowed Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.801 -0.714 . . . . 74.22 112.51 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -179.55 -73.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.888 0.375 . . . . 64.22 110.911 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . -142.36 -179.4 19.22 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.791 -0.719 . . . . 73.55 112.514 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 220' ' ' ASP . . . . . . . . . . . . . 54.7 m-20 -89.53 146.66 36.22 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.59 0.709 . . . . 73.41 110.848 -179.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.8 114.08 3.59 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.643 2.229 . . . . 74.21 112.331 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.62 -45.42 15.83 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.235 -0.438 . . . . 75.43 110.891 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 8.8 m-20 -130.43 -40.12 1.28 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.224 -0.443 . . . . 70.33 110.921 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER 65.67 127.24 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.139 -0.482 . . . . 71.11 110.895 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -143.76 161.0 39.73 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.166 -0.47 . . . . 65.02 110.907 179.941 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 36.3 mt -64.38 147.99 51.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.272 -0.422 . . . . 62.53 110.849 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 227' ' ' SER . . . . . 0.449 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 0.9 OUTLIER -87.73 150.86 23.34 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.106 -0.497 . . . . 74.21 110.832 -179.924 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 -65.08 -66.8 0.5 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.18 -0.464 . . . . 74.54 110.922 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -55.37 -26.02 38.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.208 -0.451 . . . . 74.2 110.902 179.932 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -70.37 -49.04 53.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.156 -0.474 . . . . 74.23 110.868 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 231' ' ' ILE . . . . . 0.449 HG12 ' HG3' ' A' ' 119' ' ' GLU . 9.4 mt -69.4 -44.18 80.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.263 -0.426 . . . . 73.41 111.12 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.8 -31.98 65.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.142 -0.481 . . . . 73.32 110.932 179.86 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -70.13 -46.05 52.91 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.72 -0.753 . . . . 65.45 112.48 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 15.1 tt -73.18 -32.94 40.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.784 0.326 . . . . 74.41 111.114 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -66.33 -24.35 66.51 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.147 -0.479 . . . . 71.13 110.954 179.904 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 236' ' ' LYS . . . . . 0.468 ' HD3' ' N ' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.04 -28.97 61.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.172 -0.467 . . . . 74.41 110.829 -179.983 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 237' ' ' LEU . . . . . 0.468 ' N ' ' HD3' ' A' ' 236' ' ' LYS . 5.7 tt -97.09 -23.61 16.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.251 -0.431 . . . . 75.41 110.925 179.952 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 238' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -92.45 -35.53 13.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.17 -0.468 . . . . 54.42 110.927 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -157.48 -116.31 0.49 Allowed Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.724 -0.75 . . . . 72.22 112.451 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 6.7 tttm -100.2 129.82 46.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.803 0.335 . . . . 75.42 110.894 -179.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 5.6 ptm180 -59.42 175.76 0.31 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.289 -0.414 . . . . 73.34 110.842 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -129.75 -177.91 4.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.23 -0.441 . . . . 62.43 110.909 -179.845 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -126.75 121.81 33.07 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.199 -0.455 . . . . 72.13 110.918 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 30.9 t -174.79 164.3 3.52 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.153 -0.476 . . . . 71.41 110.883 -179.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -172.0 163.01 6.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.125 -0.489 . . . . 75.43 110.921 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -175.57 38.24 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.202 -0.454 . . . . 72.11 110.87 179.954 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.16 -0.473 . . . . 74.13 110.937 179.874 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 302' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 21.1 t-105 . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.747 0.308 . . . . 71.22 110.898 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 49.7 tt0 -73.3 -35.46 66.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.267 -0.424 . . . . 72.51 110.852 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 13.3 mt-30 -62.92 -36.83 84.67 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.206 -0.452 . . . . 61.24 110.903 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.774 ' HB1' ' HE3' ' A' ' 62' ' ' MET . . . -57.1 -35.16 69.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.202 -0.454 . . . . 54.34 111.117 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.567 ' OE1' HD12 ' A' ' 35' ' ' LEU . 2.0 tt0 -64.78 -42.91 94.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.149 -0.478 . . . . 73.12 110.912 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -76.99 -31.48 56.53 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.19 -0.459 . . . . 72.4 110.87 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -60.33 -44.08 95.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.159 -0.473 . . . . 75.11 110.907 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.654 HD13 ' O ' ' A' ' 19' ' ' LEU . 3.0 tm? -71.43 -22.27 61.87 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.138 -0.483 . . . . 72.51 110.862 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.452 ' HE2' ' HA ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -72.3 -43.75 63.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.2 -0.455 . . . . 74.41 110.919 179.816 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.452 ' HA ' ' HE2' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -70.25 -27.84 64.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.445 . . . . 74.05 110.853 179.999 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -74.09 -5.72 43.33 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.21 -0.45 . . . . 74.31 110.852 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.163 -0.471 . . . . 72.55 110.943 -179.907 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.567 HD12 ' OE1' ' A' ' 16' ' ' GLN . 7.3 tt . . . . . 0 N--CA 1.458 -0.048 0 CA-C-O 120.76 0.314 . . . . 72.52 110.913 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.93 -51.12 65.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.136 -0.484 . . . . 73.13 110.857 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.31 -50.48 69.9 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.177 -0.465 . . . . 63.32 111.097 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.462 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 24.4 mmmt -59.95 -49.51 77.39 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.226 -0.443 . . . . 72.32 110.896 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.905 HD11 HD22 ' A' ' 54' ' ' LEU . 0.1 OUTLIER -56.67 -36.99 70.21 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.266 -0.425 . . . . 72.11 110.894 179.917 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.5 ttmt -58.99 -45.5 90.48 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.451 . . . . 62.43 110.856 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.462 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 2.9 pt-20 -60.58 -32.84 71.92 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.247 -0.433 . . . . 75.11 110.827 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 7.2 ttt -68.47 -34.0 75.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.171 -0.468 . . . . 63.43 110.876 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.46 ' HG3' ' HA ' ' A' ' 51' ' ' THR . 2.3 mm100 -60.65 -39.98 90.33 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.215 -0.448 . . . . 74.45 110.916 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.2 mmpt? -70.58 -33.13 70.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 71.43 110.9 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 38.4 t80 -70.77 -37.33 73.36 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.232 -0.44 . . . . 73.32 110.903 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.727 ' HB3' HD23 ' A' ' 48' ' ' LEU . 2.7 m-85 -81.91 -35.63 28.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.108 -0.496 . . . . 70.43 110.869 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.447 ' HA2' ' HB3' ' A' ' 206' ' ' SER . . . 102.98 -10.2 55.41 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.742 -0.742 . . . . 64.34 112.51 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.727 HD23 ' HB3' ' A' ' 46' ' ' PHE . 0.7 OUTLIER -61.84 139.76 95.55 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.644 0.735 . . . . 64.11 110.898 -179.926 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.77 -53.23 0.28 Allowed 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.68 2.253 . . . . 74.5 112.318 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.649 HD12 HG23 ' A' ' 58' ' ' VAL . 0.9 OUTLIER -50.64 108.27 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.209 -0.451 . . . . 71.22 111.129 179.94 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.46 ' HA ' ' HG3' ' A' ' 43' ' ' GLN . 1.2 p -96.81 155.56 16.72 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.199 -0.455 . . . . 73.25 111.138 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 57.68 20.63 40.13 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.736 -0.745 . . . . 64.24 112.49 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' MET . . . . . 0.423 ' O ' HG11 ' A' ' 58' ' ' VAL . 2.0 mtt -99.81 158.91 15.46 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.759 0.314 . . . . 75.23 110.917 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.905 HD22 HD11 ' A' ' 39' ' ' LEU . 23.4 tp -174.63 78.54 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.287 -0.415 . . . . 73.4 110.928 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 178.8 -31.22 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.242 -0.435 . . . . 44.35 110.905 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 8.5 m -91.14 -99.81 0.11 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.159 -0.473 . . . . 75.25 110.867 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 42.6 ttt85 -84.96 -29.36 25.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.11 -0.496 . . . . 61.22 110.857 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.649 HG23 HD12 ' A' ' 50' ' ' ILE . 93.1 t -64.23 -41.61 92.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.208 -0.451 . . . . 70.12 111.117 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.606 HD12 ' CD1' ' A' ' 54' ' ' LEU . 0.1 OUTLIER -75.09 -31.72 25.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.192 -0.458 . . . . 74.43 111.11 179.938 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -63.58 -44.39 94.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.186 -0.461 . . . . 73.45 110.863 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.657 HD12 ' CE2' ' A' ' 46' ' ' PHE . 24.3 pt -67.32 -30.1 47.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 74.52 111.132 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' MET . . . . . 0.774 ' HE3' ' HB1' ' A' ' 15' ' ' ALA . 1.5 mmm -66.03 -36.22 82.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.159 -0.473 . . . . 74.01 110.931 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -87.74 -22.74 24.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 42.22 110.916 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 34.7 mttp -80.4 145.11 58.8 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.561 0.696 . . . . 65.34 110.888 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.81 161.08 47.31 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.689 2.259 . . . . 72.11 112.358 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.408 ' HG3' ' HA ' ' A' ' 214' ' ' PRO . 29.0 ttp180 -161.65 -82.5 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.195 -0.457 . . . . 71.51 110.903 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -145.36 156.45 43.79 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.175 -0.466 . . . . 55.3 110.878 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.652 ' HA2' HG23 ' A' ' 155' ' ' THR . . . -96.79 14.23 64.28 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.721 -0.752 . . . . 64.23 112.452 -179.862 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.696 HG12 ' HD2' ' A' ' 70' ' ' PRO . 0.0 OUTLIER -111.22 142.09 25.68 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.636 0.731 . . . . 74.23 111.098 179.996 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 70' ' ' PRO . . . . . 0.696 ' HD2' HG12 ' A' ' 69' ' ' VAL . 53.7 Cg_endo -69.82 178.21 4.84 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.65 2.234 . . . . 63.44 112.367 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -107.97 -2.9 19.31 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.25 -0.432 . . . . 74.45 110.841 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.224 -0.443 . . . . 53.43 111.166 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 C--O 1.232 0.182 0 CA-C-O 120.836 0.265 . . . . 71.11 112.309 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.703 ' CE ' HD13 ' A' ' 237' ' ' LEU . 8.5 mttp -83.31 168.43 16.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.252 -0.431 . . . . 64.45 110.913 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' TRP . . . . . 0.508 ' CD1' ' HA ' ' A' ' 200' ' ' LEU . 35.4 m95 -53.55 131.78 39.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.248 -0.433 . . . . 73.31 110.957 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.23 1.03 13.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.272 -0.422 . . . . 65.3 111.154 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.2 m -73.39 178.28 4.68 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.237 -0.438 . . . . 70.34 110.843 -179.826 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.81 -10.22 22.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.135 -0.484 . . . . 71.12 110.882 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -156.18 142.85 10.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.221 -0.445 . . . . 74.14 111.073 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 76.8 t -116.65 130.33 71.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.15 -0.477 . . . . 72.25 111.081 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.498 HG23 ' HB3' ' A' ' 125' ' ' ARG . 0.0 OUTLIER -118.45 144.57 45.89 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.115 -0.493 . . . . 71.01 111.124 -179.967 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 4.6 p90 -137.62 146.38 43.87 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.202 -0.454 . . . . 70.51 110.937 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 6.1 ttt180 -149.4 131.68 15.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.113 -0.494 . . . . 71.25 110.833 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.484 ' H ' HD12 ' A' ' 93' ' ' ILE . 4.8 mp -75.18 132.52 33.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.191 -0.459 . . . . 72.4 111.13 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 21.6 t -86.25 -40.25 14.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.163 -0.471 . . . . 60.2 111.112 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 92.0 p -156.42 169.34 24.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.172 -0.467 . . . . 64.24 110.818 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 11.5 p90 -125.39 154.98 41.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.126 -0.488 . . . . 72.25 110.911 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.9 t -96.59 141.14 30.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.159 -0.473 . . . . 64.11 111.097 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 2.6 mmp_? -53.06 -18.22 1.97 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 72.14 110.827 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.94 -35.92 82.71 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.196 -0.456 . . . . 74.13 110.894 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.51 HD22 HG21 ' A' ' 104' ' ' THR . 1.0 OUTLIER -141.86 153.7 64.65 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.602 0.715 . . . . 72.52 110.89 -179.987 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 101' ' ' PRO . . . . . 0.564 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.6 Cg_endo -69.77 151.02 68.88 Favored 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.692 2.262 . . . . 73.11 112.356 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 11.8 t-160 -52.36 -27.6 16.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.229 -0.441 . . . . 74.11 110.833 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.564 HG22 ' HB2' ' A' ' 101' ' ' PRO . 0.0 OUTLIER -75.37 -40.5 42.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.232 -0.44 . . . . 74.02 111.141 179.991 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 104' ' ' THR . . . . . 0.651 ' O ' HD22 ' A' ' 108' ' ' LEU . 3.6 m -69.83 -38.42 76.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.138 -0.483 . . . . 52.11 111.184 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.797 ' O ' HG13 ' A' ' 109' ' ' VAL . 81.3 t -72.81 -45.55 56.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.173 -0.467 . . . . 71.51 111.134 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.674 ' O ' HG22 ' A' ' 109' ' ' VAL . 2.6 t0 -63.41 -42.6 98.77 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.183 -0.462 . . . . 63.44 110.829 179.929 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 11.2 ptm180 -70.11 -34.15 72.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.462 . . . . 75.02 110.87 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.651 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -62.08 -48.73 78.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.217 -0.447 . . . . 71.04 110.914 -179.969 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.797 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.5 m -55.4 -42.12 65.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.454 . . . . 72.31 111.114 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.469 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 48.0 t -70.22 -33.36 71.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.223 -0.444 . . . . 72.14 110.894 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.417 ' HB3' HD21 ' A' ' 189' ' ' LEU . 0.3 OUTLIER -61.84 -32.82 73.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.15 -0.477 . . . . 74.35 110.876 179.964 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -97.48 -40.31 8.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.198 -0.456 . . . . 74.32 111.059 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.843 HD12 HD12 ' A' ' 196' ' ' LEU . 0.3 OUTLIER -65.26 -33.58 76.33 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.243 -0.435 . . . . 72.0 110.88 -179.943 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 46.6 t30 -69.74 -40.55 76.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 72.34 110.9 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' MET . . . . . 0.72 ' HB3' HD23 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -58.86 -34.56 71.75 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.206 -0.452 . . . . 54.12 110.868 179.91 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 7.8 m95 -66.45 -41.33 89.25 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.211 -0.45 . . . . 75.23 110.915 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -72.72 -38.85 56.66 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.761 -0.733 . . . . 73.32 112.471 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.0 mmpt? -62.66 -16.3 56.28 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.758 0.313 . . . . 72.42 110.921 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.619 ' HB3' HG23 ' A' ' 231' ' ' ILE . 37.2 mm-40 -100.4 13.33 34.83 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.222 -0.444 . . . . 75.24 110.892 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 0.8 HD12 HD12 ' A' ' 122' ' ' LEU . 6.4 pt -148.09 152.62 40.22 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.601 0.715 . . . . 71.34 111.136 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.74 1.21 4.63 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.685 2.257 . . . . 72.21 112.325 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.8 HD12 HD12 ' A' ' 120' ' ' ILE . 4.3 mt -62.63 -156.61 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.228 -0.442 . . . . 73.22 110.936 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 44.0 t-80 -160.56 142.61 12.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.151 -0.477 . . . . 74.12 110.837 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 28.5 m-85 -121.59 148.52 44.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.182 -0.463 . . . . 75.54 110.849 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.498 ' HB3' HG23 ' A' ' 90' ' ' THR . 0.2 OUTLIER -126.97 141.69 51.73 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.136 -0.484 . . . . 75.14 110.93 -179.949 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 126' ' ' LYS . . . . . 0.57 ' HE3' HG13 ' A' ' 128' ' ' VAL . 0.1 OUTLIER -80.63 148.61 30.18 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.235 -0.439 . . . . 72.22 110.937 179.967 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 127' ' ' VAL . . . . . 0.898 HG11 ' HB2' ' A' ' 132' ' ' ALA . 25.6 m -103.14 126.31 57.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.278 -0.419 . . . . 50.13 111.087 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.602 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -144.34 -11.11 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.163 -0.471 . . . . 74.43 111.081 179.945 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 129' ' ' TRP . . . . . 0.602 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -157.44 109.17 2.35 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.193 -0.458 . . . . 71.25 110.949 179.981 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 109.77 -162.65 12.62 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.758 -0.734 . . . . 62.11 112.485 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 9.7 p -101.96 156.06 17.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.759 0.314 . . . . 63.25 111.13 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 132' ' ' ALA . . . . . 0.898 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -111.77 165.39 12.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.186 -0.461 . . . . 51.34 111.098 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -71.88 -55.13 8.07 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.22 -0.445 . . . . 75.41 110.825 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 134' ' ' ILE . . . . . 0.436 HD12 ' N ' ' A' ' 134' ' ' ILE . 5.0 mp -95.37 108.8 21.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.251 -0.432 . . . . 70.51 111.114 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 14.2 mmm -90.76 127.75 36.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.189 -0.459 . . . . 72.43 110.941 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.42 ' O ' HG23 ' A' ' 93' ' ' ILE . 0.8 OUTLIER -106.24 95.14 3.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.263 -0.426 . . . . 70.04 111.147 179.948 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -132.06 163.52 23.88 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.753 -0.737 . . . . 63.34 112.517 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 138' ' ' PHE . . . . . 0.487 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 49.9 m-85 -105.22 150.03 25.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.864 0.364 . . . . 74.01 110.885 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.566 ' HB1' ' CB ' ' A' ' 143' ' ' HIS . . . 174.45 166.89 0.24 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.107 -0.497 . . . . 71.21 111.122 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.403 ' HB3' ' HB3' ' A' ' 149' ' ' PHE . 29.4 mtm180 -104.41 173.2 6.4 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.211 -0.45 . . . . 62.21 110.865 -179.883 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -57.28 -15.91 17.82 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.758 -0.734 . . . . 74.24 112.464 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -96.51 13.3 28.49 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.756 0.312 . . . . 75.03 111.039 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 143' ' ' HIS . . . . . 0.566 ' CB ' ' HB1' ' A' ' 139' ' ' ALA . 4.1 p80 -75.81 -5.15 44.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.245 -0.434 . . . . 71.11 110.862 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 121.37 20.41 3.28 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.741 -0.742 . . . . 45.51 112.498 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -124.76 173.31 8.66 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.843 0.354 . . . . 72.14 110.864 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 20.5 m -75.42 170.51 15.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.196 -0.456 . . . . 51.25 110.846 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 64.89 132.57 0.03 OUTLIER Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.703 0.763 . . . . 73.4 110.928 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 152.01 69.11 Favored 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.708 2.272 . . . . 74.53 112.372 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 149' ' ' PHE . . . . . 0.443 ' C ' ' H ' ' A' ' 151' ' ' GLY . 21.3 p90 -53.01 -41.4 64.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.243 -0.435 . . . . 63.52 110.877 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 76.19 -25.13 0.21 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.171 -0.468 . . . . 63.11 110.902 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 151' ' ' GLY . . . . . 0.443 ' H ' ' C ' ' A' ' 149' ' ' PHE . . . 77.07 -151.35 38.68 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.74 -0.743 . . . . 71.41 112.481 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.75 142.15 47.18 Favored 'Trans proline' 0 C--N 1.341 0.137 0 C-N-CA 122.704 2.269 . . . . 75.11 112.333 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 153' ' ' GLY . . . . . 0.434 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 104.15 -137.19 13.43 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.725 -0.75 . . . . 70.32 112.418 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 154' ' ' ASN . . . . . 0.434 ' C ' ' O ' ' A' ' 153' ' ' GLY . 4.1 p30 -34.53 138.09 0.11 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.955 0.407 . . . . 73.25 110.886 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 155' ' ' THR . . . . . 0.652 HG23 ' HA2' ' A' ' 68' ' ' GLY . 1.5 m 73.29 112.23 0.06 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.166 -0.47 . . . . 44.41 111.171 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 156' ' ' LEU . . . . . 1.042 HD21 HG21 ' A' ' 186' ' ' ILE . 0.6 OUTLIER -94.92 -53.09 3.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.244 -0.434 . . . . 75.02 110.918 179.975 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 157' ' ' ALA . . . . . 0.548 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -163.85 148.58 10.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.201 -0.454 . . . . 71.42 111.107 179.773 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 16.1 p-80 -106.8 124.37 49.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 72.02 110.917 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -110.48 152.39 26.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.254 -0.43 . . . . 74.42 111.108 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -105.46 151.86 23.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.231 -0.44 . . . . 75.31 110.876 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 161' ' ' ALA . . . . . 0.702 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -82.79 164.06 48.56 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.581 0.705 . . . . 61.04 111.111 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 162' ' ' PRO . . . . . 0.702 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.9 Cg_endo -69.79 79.17 0.97 Allowed 'Trans proline' 0 C--N 1.34 0.127 0 C-N-CA 122.661 2.241 . . . . 74.44 112.347 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -137.98 124.71 3.03 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.73 -0.748 . . . . 61.41 112.497 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 63.31 -171.1 0.17 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.797 0.332 . . . . 73.1 111.135 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -86.0 -41.32 7.17 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.74 -0.743 . . . . 74.03 112.465 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 166' ' ' LEU . . . . . 0.43 ' C ' HD23 ' A' ' 166' ' ' LEU . 10.2 tt -71.32 -37.21 71.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.837 0.351 . . . . 65.12 110.913 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -79.11 161.24 47.12 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.766 -0.731 . . . . 43.43 112.488 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 91.29 23.08 30.24 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.765 -0.731 . . . . 74.31 112.54 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -94.42 167.03 11.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.848 0.356 . . . . 63.41 110.878 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.46 130.69 55.9 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.207 -0.451 . . . . 74.21 111.105 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 24.6 m170 -126.29 158.6 35.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.225 -0.443 . . . . 72.53 110.881 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -142.99 138.83 30.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.208 -0.451 . . . . 71.44 110.85 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 59.2 t0 -69.21 97.8 0.96 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.138 -0.483 . . . . 74.11 110.887 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.41 -17.04 10.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.228 -0.442 . . . . 72.25 110.844 -179.869 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -78.97 -16.12 57.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.464 . . . . 73.32 110.824 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -80.13 -174.96 4.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.229 -0.441 . . . . 63.2 110.911 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 24.7 mtm-85 -109.41 107.23 17.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 63.14 110.877 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 68.2 m95 -108.56 137.17 46.94 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.219 -0.446 . . . . 72.31 110.945 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 179' ' ' THR . . . . . 0.508 ' HA ' HD11 ' A' ' 100' ' ' LEU . 11.1 t -178.33 163.59 1.63 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.266 -0.425 . . . . 74.13 111.14 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -125.54 -72.59 0.66 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.18 -0.464 . . . . 45.33 110.871 179.89 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -60.25 -16.16 40.83 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.702 -0.761 . . . . 62.41 112.514 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 182' ' ' SER . . . . . 0.432 ' O ' ' C ' ' A' ' 183' ' ' SER . 0.3 OUTLIER -90.62 -24.38 20.54 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.909 0.385 . . . . 64.5 110.933 -179.781 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 183' ' ' SER . . . . . 0.432 ' C ' ' O ' ' A' ' 182' ' ' SER . 91.0 p 35.61 58.17 0.87 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.087 -0.506 . . . . 64.12 110.866 -179.847 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 9.1 tt -116.75 -33.5 4.79 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.09 -0.505 . . . . 74.2 110.91 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -119.38 -139.29 5.94 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.752 -0.737 . . . . 73.01 112.488 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 186' ' ' ILE . . . . . 1.042 HG21 HD21 ' A' ' 156' ' ' LEU . 8.5 mm -79.54 100.32 4.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.882 0.372 . . . . 73.22 111.162 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -48.96 119.13 2.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.136 -0.484 . . . . 71.31 110.888 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 188' ' ' PHE . . . . . 0.589 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.2 t80 -53.72 -34.36 58.6 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.172 -0.467 . . . . 75.45 110.891 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 189' ' ' LEU . . . . . 0.417 HD21 ' HB3' ' A' ' 111' ' ' LYS . 0.2 OUTLIER -67.16 -48.18 68.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.15 -0.477 . . . . 52.02 110.939 -179.991 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -70.12 -37.75 75.41 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.204 -0.453 . . . . 74.22 110.912 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 191' ' ' ALA . . . . . 0.58 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -72.63 -35.47 67.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.104 -0.498 . . . . 50.03 111.138 179.883 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 192' ' ' ALA . . . . . 0.715 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -60.79 -45.09 95.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.193 -0.458 . . . . 52.11 111.121 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 193' ' ' THR . . . . . 0.771 HG21 HG21 ' A' ' 211' ' ' VAL . 11.1 m -58.76 -44.99 90.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.17 -0.468 . . . . 72.43 111.12 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 6.8 t60 -73.04 -39.79 65.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.216 -0.447 . . . . 71.44 110.857 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -71.76 -48.13 48.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.178 -0.464 . . . . 71.01 111.102 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 196' ' ' LEU . . . . . 0.843 HD12 HD12 ' A' ' 113' ' ' LEU . 4.5 mm? -62.11 -37.01 83.46 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.243 -0.435 . . . . 74.51 110.917 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -60.74 -27.69 66.91 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.762 -0.733 . . . . 52.23 112.512 179.876 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 198' ' ' HIS . . . . . 0.406 ' CD2' HG21 ' A' ' 69' ' ' VAL . 6.5 m-70 -67.31 -35.07 78.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.752 0.31 . . . . 75.21 110.806 -179.948 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -68.73 -21.46 64.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.214 -0.448 . . . . 71.13 110.855 -179.774 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 200' ' ' LEU . . . . . 0.508 ' HA ' ' CD1' ' A' ' 84' ' ' TRP . 0.5 OUTLIER -88.53 2.11 53.57 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.12 -0.491 . . . . 64.13 110.91 -179.992 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 84.04 -7.67 70.03 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.731 -0.747 . . . . 50.41 112.474 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 202' ' ' MET . . . . . 0.622 ' SD ' HD12 ' A' ' 234' ' ' ILE . 98.7 mmm -53.92 167.47 0.27 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.781 0.324 . . . . 63.21 110.868 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -137.1 161.4 25.18 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.719 -0.753 . . . . 64.44 112.512 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 13.2 m-70 -57.43 143.85 38.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.824 0.345 . . . . 74.32 110.835 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -105.92 152.52 23.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 53.34 110.897 -179.835 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 206' ' ' SER . . . . . 0.447 ' HB3' ' HA2' ' A' ' 47' ' ' GLY . 1.1 m -88.07 -4.77 58.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.156 -0.474 . . . . 72.22 110.853 -179.802 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.55 138.98 83.52 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-O 121.603 0.716 . . . . 65.11 110.865 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 -7.92 22.29 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.684 2.256 . . . . 74.53 112.36 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 -125.72 28.91 6.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.234 -0.439 . . . . 63.52 110.915 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 210' ' ' ALA . . . . . 0.436 ' O ' ' HB2' ' A' ' 213' ' ' TYR . . . -87.11 145.61 26.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.151 -0.477 . . . . 62.23 111.09 179.879 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 211' ' ' VAL . . . . . 0.771 HG21 HG21 ' A' ' 193' ' ' THR . 0.3 OUTLIER -73.24 -26.05 22.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.459 . . . . 62.04 111.158 179.963 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 11.3 mmm -93.78 10.07 34.56 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.138 -0.483 . . . . 75.22 110.884 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 213' ' ' TYR . . . . . 0.443 ' CD1' ' HD2' ' A' ' 214' ' ' PRO . 0.5 OUTLIER -55.54 127.54 66.45 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.669 0.747 . . . . 73.43 110.918 -179.865 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 214' ' ' PRO . . . . . 0.443 ' HD2' ' CD1' ' A' ' 213' ' ' TYR . 54.0 Cg_endo -69.75 -18.47 37.03 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.634 2.222 . . . . 63.01 112.379 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 1.2 p -90.16 32.16 0.95 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.197 -0.456 . . . . 74.24 111.129 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 6.5 t80 . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.175 -0.466 . . . . 74.14 110.929 -179.928 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.074 0 CA-C-O 120.962 0.41 . . . . 65.01 110.871 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.98 -164.68 1.94 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.123 -0.49 . . . . 64.24 110.883 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 226' ' ' LEU . . . . . 0.72 HD23 ' HB3' ' A' ' 115' ' ' MET . 1.4 mm? -59.28 148.77 30.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.255 -0.43 . . . . 53.44 110.863 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 227' ' ' SER . . . . . 0.479 ' O ' HD12 ' A' ' 231' ' ' ILE . 10.5 t -86.93 163.43 17.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.184 -0.462 . . . . 74.21 110.841 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -64.88 -62.28 1.66 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.092 -0.504 . . . . 74.54 110.889 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -55.57 -28.47 55.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.179 -0.464 . . . . 72.22 110.833 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -69.22 -48.61 61.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.181 -0.463 . . . . 74.23 110.892 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 231' ' ' ILE . . . . . 0.619 HG23 ' HB3' ' A' ' 119' ' ' GLU . 7.9 mt -68.86 -41.73 82.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.165 -0.471 . . . . 73.41 111.123 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 33.7 pttt -65.65 -32.58 74.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.193 -0.458 . . . . 65.42 110.873 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -64.88 -47.22 85.34 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.773 -0.727 . . . . 63.43 112.466 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 234' ' ' ILE . . . . . 0.622 HD12 ' SD ' ' A' ' 202' ' ' MET . 8.5 tt -72.55 -30.32 33.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.792 0.329 . . . . 71.54 111.123 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -68.73 -23.81 64.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.181 -0.463 . . . . 70.33 110.896 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 236' ' ' LYS . . . . . 0.463 ' HD3' ' N ' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.31 -27.98 60.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.168 -0.469 . . . . 51.21 110.909 179.975 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 237' ' ' LEU . . . . . 0.703 HD13 ' CE ' ' A' ' 83' ' ' LYS . 9.9 tt -95.77 -31.25 13.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.199 -0.455 . . . . 75.41 110.901 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 238' ' ' TYR . . . . . . . . . . . . . 30.7 m-85 -92.02 -35.03 14.18 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.199 -0.455 . . . . 51.24 110.953 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.333 0 C-N-CA 120.781 -0.724 . . . . 32.22 112.506 179.943 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 16.2 t-105 . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.747 0.308 . . . . 71.22 110.898 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -67.16 -35.59 80.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.2 -0.454 . . . . 72.51 110.853 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.51 -37.61 88.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.183 -0.462 . . . . 61.24 110.908 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.1 -37.25 86.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.23 -0.441 . . . . 54.34 111.106 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -65.36 -42.85 92.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.219 -0.446 . . . . 73.12 110.85 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -76.55 -31.65 57.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.289 -0.414 . . . . 72.4 110.855 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -60.36 -43.65 96.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.213 -0.449 . . . . 75.11 110.934 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.617 HD22 ' CE2' ' A' ' 23' ' ' TYR . 0.8 OUTLIER -71.4 -21.24 62.02 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.15 -0.477 . . . . 72.51 110.93 179.89 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -71.55 -48.24 49.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.221 -0.445 . . . . 74.41 110.852 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.83 -28.53 69.92 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.258 -0.428 . . . . 74.05 110.883 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -62.59 -25.26 67.99 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.18 -0.464 . . . . 74.31 110.861 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.617 ' CE2' HD22 ' A' ' 19' ' ' LEU . 5.4 m-85 . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.125 -0.489 . . . . 72.55 110.937 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.503 ' O ' HD13 ' A' ' 39' ' ' LEU . 1.0 OUTLIER . . . . . 0 C--O 1.231 0.081 0 CA-C-O 120.771 0.319 . . . . 72.52 110.903 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.1 -51.67 62.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.26 -0.427 . . . . 73.13 110.841 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.74 -44.13 86.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.47 . . . . 63.32 111.165 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.99 -38.3 82.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.208 -0.451 . . . . 72.32 110.844 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.503 HD13 ' O ' ' A' ' 35' ' ' LEU . 4.6 mp -67.45 -35.49 79.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.232 -0.44 . . . . 72.11 110.956 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.46 -45.93 87.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 62.43 110.899 179.863 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.54 ' HG3' ' N ' ' A' ' 42' ' ' MET . 0.0 OUTLIER -60.34 -31.92 70.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 75.11 110.943 179.902 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.553 ' SD ' HD11 ' A' ' 19' ' ' LEU . 1.4 ttt -68.27 -34.23 75.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.098 -0.501 . . . . 63.43 110.904 179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.434 HE22 HG21 ' A' ' 58' ' ' VAL . 1.5 mm-40 -62.22 -39.48 92.95 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.242 -0.435 . . . . 74.45 110.911 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.1 mmpt? -68.59 -27.33 65.96 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.209 -0.45 . . . . 71.43 110.908 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 34.4 t80 -69.79 -45.63 67.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.225 -0.443 . . . . 73.32 110.898 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.807 ' CZ ' HD13 ' A' ' 61' ' ' ILE . 8.5 m-85 -82.83 -34.52 26.86 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.096 -0.502 . . . . 70.43 110.907 -179.917 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 100.13 -3.05 56.77 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.719 -0.753 . . . . 64.34 112.486 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.553 HD23 ' CB ' ' A' ' 46' ' ' PHE . 0.5 OUTLIER -59.86 142.17 88.79 Favored Pre-proline 0 C--N 1.328 -0.356 0 CA-C-O 121.616 0.722 . . . . 64.11 110.856 -179.847 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.77 -52.55 0.32 Allowed 'Trans proline' 0 C--N 1.342 0.219 0 C-N-CA 122.706 2.271 . . . . 74.5 112.314 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.607 HD12 HG23 ' A' ' 58' ' ' VAL . 0.8 OUTLIER -52.67 108.24 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.262 -0.427 . . . . 71.22 111.128 179.953 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.405 ' HA ' ' HG3' ' A' ' 43' ' ' GLN . 1.5 t -108.58 158.5 17.51 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.214 -0.448 . . . . 73.25 111.153 179.93 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 58.61 18.06 36.41 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.722 -0.752 . . . . 64.24 112.545 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 1.9 mmm -118.95 161.14 20.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.799 0.333 . . . . 75.23 110.902 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.418 ' HA ' ' HB ' ' A' ' 58' ' ' VAL . 53.2 tp -157.64 83.87 0.89 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.273 -0.421 . . . . 73.4 110.961 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -179.59 -31.9 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.173 -0.467 . . . . 44.35 110.859 179.951 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' SER . . . . . 0.419 ' HB3' HD13 ' A' ' 50' ' ' ILE . 28.9 t -80.12 -101.3 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.211 -0.449 . . . . 75.25 110.832 -179.808 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.43 ' HB3' HD11 ' A' ' 50' ' ' ILE . 0.1 OUTLIER -84.89 -28.15 26.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 61.22 110.924 -179.992 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.607 HG23 HD12 ' A' ' 50' ' ' ILE . 90.5 t -59.52 -43.35 90.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.188 -0.46 . . . . 70.12 111.066 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.412 HG12 HD12 ' A' ' 54' ' ' LEU . 3.9 mm -75.13 -31.36 24.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.199 -0.455 . . . . 74.43 111.105 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -59.56 -44.08 93.38 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 73.45 110.923 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.807 HD13 ' CZ ' ' A' ' 46' ' ' PHE . 1.6 pp -74.57 -29.25 23.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.18 -0.464 . . . . 74.52 111.157 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -57.95 -41.25 82.42 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.194 -0.457 . . . . 74.01 110.903 179.794 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -89.33 -24.47 21.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.26 -0.427 . . . . 42.22 110.888 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 10.2 mttm -85.22 120.05 72.99 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.594 0.711 . . . . 65.34 110.894 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.73 151.63 69.25 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.686 2.258 . . . . 72.11 112.36 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.76 -64.2 0.22 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.176 -0.465 . . . . 71.51 110.825 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 13.9 p -145.04 149.6 35.39 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.237 -0.438 . . . . 55.3 110.885 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.536 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -104.72 18.26 44.21 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.733 -0.746 . . . . 64.23 112.456 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.615 HG21 ' CD2' ' A' ' 198' ' ' HIS . 0.6 OUTLIER -96.16 135.54 22.6 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.576 0.703 . . . . 74.23 111.175 179.982 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 70' ' ' PRO . . . . . 0.5 ' HD2' HG12 ' A' ' 69' ' ' VAL . 52.9 Cg_endo -69.87 143.06 49.1 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.677 2.251 . . . . 63.44 112.268 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -100.2 26.49 6.46 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.164 -0.471 . . . . 74.45 110.858 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 116.176 -0.466 . . . . 53.43 111.152 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.473 ' HG2' ' H ' ' A' ' 83' ' ' LYS . 53.8 Cg_endo . . . . . 0 C--O 1.231 0.145 0 CA-C-O 120.835 0.265 . . . . 71.11 112.368 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.801 ' HD2' HD22 ' A' ' 237' ' ' LEU . 4.4 mttp -45.13 141.86 2.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.199 -0.455 . . . . 64.45 110.914 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' TRP . . . . . 0.67 ' CE3' HG21 ' A' ' 89' ' ' VAL . 40.5 m0 -47.05 109.87 0.24 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.223 -0.444 . . . . 73.31 110.907 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -114.09 -6.98 13.09 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.288 -0.414 . . . . 65.3 111.146 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -58.18 168.64 0.99 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.209 -0.45 . . . . 70.34 110.883 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 18.7 mttp -73.96 -30.55 62.59 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.095 -0.502 . . . . 71.12 110.942 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -159.84 144.93 6.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.215 -0.448 . . . . 74.14 111.17 179.841 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.67 HG21 ' CE3' ' A' ' 84' ' ' TRP . 13.0 t -126.2 140.96 47.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.194 -0.457 . . . . 72.25 111.082 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 76.8 p -122.38 166.52 14.58 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.172 -0.467 . . . . 71.01 111.17 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.407 ' HB3' ' HB ' ' A' ' 134' ' ' ILE . 3.9 p90 -151.42 146.29 25.85 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.261 -0.427 . . . . 70.51 110.915 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 17.2 ttt180 -146.33 137.42 24.4 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.139 -0.482 . . . . 71.25 110.952 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.424 ' N ' HD12 ' A' ' 93' ' ' ILE . 3.5 mp -75.0 135.44 27.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.182 -0.463 . . . . 72.4 111.144 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.449 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 21.8 t -89.25 -40.63 13.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.225 -0.443 . . . . 60.2 111.114 179.846 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 1.7 t -143.74 161.83 37.59 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.197 -0.456 . . . . 64.24 110.861 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 11.8 p90 -110.19 153.25 25.03 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.129 -0.487 . . . . 72.25 110.901 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.493 ' OG1' HG21 ' A' ' 105' ' ' VAL . 0.2 OUTLIER -82.61 140.94 32.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.139 -0.482 . . . . 64.11 111.112 -179.966 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 6.5 ppt_? -73.67 -7.66 52.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.276 -0.42 . . . . 72.14 110.863 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -96.57 -25.98 15.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.194 -0.457 . . . . 74.13 110.869 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.612 HD21 ' HA ' ' A' ' 179' ' ' THR . 0.6 OUTLIER -133.64 153.73 80.32 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.599 0.714 . . . . 72.52 110.914 -179.959 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 101' ' ' PRO . . . . . 0.606 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.9 Cg_endo -69.69 150.91 69.24 Favored 'Trans proline' 0 C--O 1.231 0.151 0 C-N-CA 122.723 2.282 . . . . 73.11 112.318 179.902 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 16.3 t-160 -53.35 -25.57 15.73 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.233 -0.44 . . . . 74.11 110.83 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.606 HG22 ' HB2' ' A' ' 101' ' ' PRO . 13.2 tt -76.58 -38.74 31.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.231 -0.441 . . . . 74.02 111.134 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 104' ' ' THR . . . . . 0.655 ' O ' HD22 ' A' ' 108' ' ' LEU . 3.1 m -69.21 -39.94 78.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.197 -0.456 . . . . 52.11 111.197 179.911 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.717 ' O ' HG13 ' A' ' 109' ' ' VAL . 91.6 t -72.7 -45.95 55.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 71.51 111.169 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.674 ' O ' HG22 ' A' ' 109' ' ' VAL . 4.8 t0 -63.41 -43.33 97.81 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.108 -0.496 . . . . 63.44 110.831 179.939 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -70.16 -33.63 72.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.139 -0.482 . . . . 75.02 110.825 -179.827 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.655 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -60.7 -48.72 80.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.216 -0.447 . . . . 71.04 110.937 -179.989 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.717 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.5 m -55.28 -41.58 62.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.263 -0.426 . . . . 72.31 111.132 179.836 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.461 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 42.9 t -70.13 -33.43 71.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 72.14 110.906 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.428 ' HB3' HD21 ' A' ' 189' ' ' LEU . 0.4 OUTLIER -61.93 -32.92 73.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.081 -0.509 . . . . 74.35 110.875 179.971 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.69 -40.91 8.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.239 -0.437 . . . . 74.32 111.13 179.842 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.76 HD12 HD12 ' A' ' 196' ' ' LEU . 0.4 OUTLIER -65.69 -34.12 77.46 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.199 -0.455 . . . . 72.0 110.971 179.944 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -69.36 -35.11 75.53 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.199 -0.455 . . . . 72.34 110.904 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' MET . . . . . 0.4 ' O ' HD11 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -67.07 -34.98 78.84 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.181 -0.463 . . . . 54.12 110.963 179.857 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 6.8 m95 -64.47 -49.18 72.41 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.216 -0.447 . . . . 75.23 110.92 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' GLY . . . . . 0.409 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -71.84 -29.86 66.7 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.703 -0.761 . . . . 73.32 112.479 -179.918 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.2 mtmt -61.36 -17.71 55.24 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.817 0.342 . . . . 72.42 110.923 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.797 ' HB3' HG23 ' A' ' 231' ' ' ILE . 18.7 mm-40 -97.96 13.26 31.4 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.124 -0.489 . . . . 75.24 110.901 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 0.903 HD12 HD12 ' A' ' 122' ' ' LEU . 3.3 pt -148.28 144.96 19.37 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.631 0.729 . . . . 71.34 111.096 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.69 28.17 0.18 Allowed 'Trans proline' 0 C--O 1.232 0.206 0 C-N-CA 122.72 2.28 . . . . 72.21 112.316 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.903 HD12 HD12 ' A' ' 120' ' ' ILE . 10.3 mt -76.83 -160.25 0.15 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.275 -0.42 . . . . 73.22 110.911 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 4.1 t-80 -153.49 120.95 5.88 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.165 -0.47 . . . . 74.12 110.831 179.859 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 9.3 m-30 -110.31 142.74 41.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.189 -0.46 . . . . 75.54 110.838 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -123.84 141.23 52.22 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.123 -0.49 . . . . 75.14 110.857 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.14 157.79 25.19 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.188 -0.46 . . . . 72.22 110.894 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 127' ' ' VAL . . . . . 0.857 HG11 ' HB2' ' A' ' 132' ' ' ALA . 25.2 m -103.15 126.32 57.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.208 -0.451 . . . . 50.13 111.149 179.816 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.599 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -145.82 -10.77 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.227 -0.442 . . . . 74.43 111.164 179.878 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 129' ' ' TRP . . . . . 0.599 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -156.57 109.18 2.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.177 -0.465 . . . . 71.25 110.888 179.991 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 105.28 -163.34 14.24 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.754 -0.736 . . . . 62.11 112.471 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -101.88 156.42 17.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.792 0.329 . . . . 63.25 111.101 -179.836 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 132' ' ' ALA . . . . . 0.857 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -111.41 165.27 12.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.16 -0.473 . . . . 51.34 111.127 179.892 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -76.74 -53.69 7.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.269 -0.423 . . . . 75.41 110.918 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 134' ' ' ILE . . . . . 0.644 HD12 ' N ' ' A' ' 134' ' ' ILE . 1.9 mp -89.92 107.76 18.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.21 -0.45 . . . . 70.51 111.085 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 135' ' ' MET . . . . . 0.449 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 22.0 mmm -95.79 130.94 42.57 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.15 -0.477 . . . . 72.43 110.878 179.814 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.533 ' CD1' HG22 ' A' ' 134' ' ' ILE . 0.3 OUTLIER -111.22 90.29 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.186 -0.461 . . . . 70.04 111.113 179.964 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 137' ' ' GLY . . . . . 0.415 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -130.02 167.46 21.72 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.769 -0.729 . . . . 63.34 112.522 179.899 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 138' ' ' PHE . . . . . 0.448 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 46.8 m-85 -105.49 150.88 24.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.9 0.381 . . . . 74.01 110.908 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.574 ' HB1' ' CB ' ' A' ' 143' ' ' HIS . . . 177.01 167.42 0.54 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.179 -0.464 . . . . 71.21 111.13 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 6.7 mtp180 -103.94 173.09 6.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.172 -0.467 . . . . 62.21 110.913 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -57.91 -15.55 20.89 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.73 -0.747 . . . . 74.24 112.506 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -98.74 13.32 32.68 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.831 0.348 . . . . 75.03 111.104 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 143' ' ' HIS . . . . . 0.574 ' CB ' ' HB1' ' A' ' 139' ' ' ALA . 6.2 p80 -71.48 -9.36 58.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.242 -0.435 . . . . 71.11 110.871 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 118.99 49.84 0.32 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.748 -0.739 . . . . 45.51 112.461 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -170.23 -176.78 2.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.767 0.318 . . . . 72.14 110.877 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -76.19 -179.74 5.21 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.259 -0.428 . . . . 51.25 110.903 -179.787 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 147' ' ' TYR . . . . . 0.43 ' HA ' ' HD2' ' A' ' 148' ' ' PRO . 0.2 OUTLIER 65.01 107.31 0.03 OUTLIER Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 121.656 0.741 . . . . 73.4 110.863 -179.922 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 148' ' ' PRO . . . . . 0.43 ' HD2' ' HA ' ' A' ' 147' ' ' TYR . 53.8 Cg_endo -69.76 151.9 69.19 Favored 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.689 2.259 . . . . 74.53 112.334 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 149' ' ' PHE . . . . . 0.419 ' O ' ' CG ' ' A' ' 150' ' ' ASP . 0.4 OUTLIER -53.43 -25.51 16.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.242 -0.435 . . . . 63.52 110.89 179.98 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 150' ' ' ASP . . . . . 0.419 ' CG ' ' O ' ' A' ' 149' ' ' PHE . 2.0 p30 45.38 24.44 0.16 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.151 -0.477 . . . . 63.11 110.821 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 42.62 -160.52 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.743 -0.741 . . . . 71.41 112.511 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 144.55 54.38 Favored 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.701 2.267 . . . . 75.11 112.312 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 153' ' ' GLY . . . . . 0.457 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 105.97 -133.87 11.82 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.673 -0.775 . . . . 70.32 112.471 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 154' ' ' ASN . . . . . 0.457 ' C ' ' O ' ' A' ' 153' ' ' GLY . 3.3 p30 -33.67 136.64 0.11 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.906 0.384 . . . . 73.25 110.883 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 155' ' ' THR . . . . . 0.497 HG23 ' HA2' ' A' ' 68' ' ' GLY . 0.3 OUTLIER 75.35 107.77 0.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.124 -0.489 . . . . 44.41 111.132 -179.997 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 156' ' ' LEU . . . . . 1.043 HD21 HG21 ' A' ' 186' ' ' ILE . 0.7 OUTLIER -91.86 -55.21 3.55 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.258 -0.428 . . . . 75.02 110.949 179.924 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 157' ' ' ALA . . . . . 0.562 ' HB1' ' O ' ' A' ' 171' ' ' HIS . . . -158.76 148.88 19.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.198 -0.456 . . . . 71.42 111.136 179.758 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 26.1 p-80 -110.41 122.59 48.07 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.262 -0.426 . . . . 72.02 110.88 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 159' ' ' ALA . . . . . 0.486 ' H ' HG22 ' A' ' 69' ' ' VAL . . . -110.52 161.1 16.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.231 -0.441 . . . . 74.42 111.075 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 18.9 m-30 -112.3 134.72 53.68 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.254 -0.43 . . . . 75.31 110.897 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 161' ' ' ALA . . . . . 0.639 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -63.97 162.73 27.81 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.53 0.681 . . . . 61.04 111.091 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 162' ' ' PRO . . . . . 0.639 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 54.4 Cg_endo -69.73 71.59 1.49 Allowed 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.687 2.258 . . . . 74.44 112.366 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -136.08 110.1 0.78 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.776 -0.726 . . . . 61.41 112.537 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 67.1 165.93 0.22 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.89 0.376 . . . . 73.1 111.1 -179.839 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -54.72 -35.7 58.17 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.701 -0.762 . . . . 74.03 112.489 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.84 -19.53 63.46 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.896 0.379 . . . . 65.12 110.938 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -88.47 167.0 35.06 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.718 -0.753 . . . . 43.43 112.479 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 168' ' ' GLY . . . . . 0.427 ' O ' HG13 ' A' ' 134' ' ' ILE . . . 80.47 -1.95 79.91 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.81 -0.71 . . . . 74.31 112.482 -179.906 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -70.57 148.3 48.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.846 0.355 . . . . 63.41 110.835 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.3 130.16 56.04 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.215 -0.448 . . . . 74.21 111.047 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 171' ' ' HIS . . . . . 0.562 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 26.5 m170 -129.69 132.18 46.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.224 -0.444 . . . . 72.53 110.885 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -114.23 138.94 49.83 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.235 -0.439 . . . . 71.44 110.849 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 57.8 t0 -70.63 97.82 1.4 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.157 -0.474 . . . . 74.11 110.877 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.92 -16.69 7.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.222 -0.445 . . . . 72.25 110.933 -179.904 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -78.39 -16.16 57.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.168 -0.469 . . . . 73.32 110.851 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -84.94 -173.54 4.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.21 -0.45 . . . . 63.2 110.885 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 45.6 mtt85 -111.75 109.73 19.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.142 -0.481 . . . . 63.14 110.872 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 70.7 m95 -109.75 138.27 46.36 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.199 -0.455 . . . . 72.31 110.884 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 179' ' ' THR . . . . . 0.612 ' HA ' HD21 ' A' ' 100' ' ' LEU . 11.4 t -177.76 163.54 1.86 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.279 -0.419 . . . . 74.13 111.165 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -127.29 -72.04 0.65 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.204 -0.453 . . . . 45.33 110.826 179.916 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -58.67 -16.94 32.21 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.668 -0.777 . . . . 62.41 112.5 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 182' ' ' SER . . . . . 0.411 ' O ' ' C ' ' A' ' 183' ' ' SER . 1.2 m -92.56 -24.32 18.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.853 0.359 . . . . 64.5 110.846 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 183' ' ' SER . . . . . 0.411 ' C ' ' O ' ' A' ' 182' ' ' SER . 4.5 p 37.36 51.82 1.18 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.187 -0.46 . . . . 64.12 110.832 -179.802 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 41.8 tp -109.18 -33.44 6.87 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.112 -0.495 . . . . 74.2 110.947 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -118.74 -138.51 5.87 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.686 -0.769 . . . . 73.01 112.401 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 186' ' ' ILE . . . . . 1.043 HG21 HD21 ' A' ' 156' ' ' LEU . 8.2 mm -79.39 101.76 4.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.908 0.385 . . . . 73.22 111.165 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -49.38 119.18 3.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.162 -0.472 . . . . 71.31 110.895 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 188' ' ' PHE . . . . . 0.586 ' HD2' ' HB3' ' A' ' 108' ' ' LEU . 1.0 OUTLIER -53.99 -33.03 55.92 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.194 -0.457 . . . . 75.45 110.87 -179.99 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 189' ' ' LEU . . . . . 0.428 HD21 ' HB3' ' A' ' 111' ' ' LYS . 0.2 OUTLIER -67.24 -48.25 68.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.11 -0.495 . . . . 52.02 110.913 -179.945 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 23.0 t80 -70.4 -37.01 74.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.234 -0.439 . . . . 74.22 110.891 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 191' ' ' ALA . . . . . 0.473 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -72.65 -36.9 68.07 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.148 -0.478 . . . . 50.03 111.107 179.878 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 192' ' ' ALA . . . . . 0.704 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -57.9 -45.08 87.02 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.209 -0.45 . . . . 52.11 111.159 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 193' ' ' THR . . . . . 0.415 HG21 HG21 ' A' ' 211' ' ' VAL . 0.2 OUTLIER -59.58 -43.13 93.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.193 -0.458 . . . . 72.43 111.177 -179.975 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 4.9 t60 -72.59 -38.23 67.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.3 -0.409 . . . . 71.44 110.902 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -75.17 -47.36 28.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.235 -0.439 . . . . 71.01 111.108 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 196' ' ' LEU . . . . . 0.76 HD12 HD12 ' A' ' 113' ' ' LEU . 4.5 mm? -64.6 -43.72 92.87 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.27 -0.423 . . . . 74.51 110.908 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -57.4 -27.98 58.75 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.679 -0.772 . . . . 52.23 112.485 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 198' ' ' HIS . . . . . 0.615 ' CD2' HG21 ' A' ' 69' ' ' VAL . 4.8 m-70 -66.79 -43.88 82.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.764 0.316 . . . . 75.21 110.818 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.21 -21.83 64.2 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 71.13 110.837 -179.8 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 200' ' ' LEU . . . . . 0.433 ' O ' ' HA ' ' A' ' 83' ' ' LYS . 4.3 mt -84.68 -0.93 55.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.142 -0.481 . . . . 64.13 110.97 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 83.48 -3.97 83.23 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.721 -0.752 . . . . 50.41 112.501 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 202' ' ' MET . . . . . 0.59 ' SD ' HD12 ' A' ' 234' ' ' ILE . 99.6 mmm -51.79 172.79 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.855 0.359 . . . . 63.21 110.853 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -132.73 160.17 23.71 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.746 -0.74 . . . . 64.44 112.433 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 22.6 m-70 -61.53 161.73 9.21 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.786 0.327 . . . . 74.32 110.852 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -125.05 147.49 48.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.213 -0.448 . . . . 53.34 110.846 -179.786 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 8.3 p -87.92 -3.93 58.88 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.153 -0.476 . . . . 72.22 110.877 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -70.93 137.77 85.11 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.659 0.742 . . . . 65.11 110.823 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -69.85 -6.23 18.14 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.693 2.262 . . . . 74.53 112.277 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -130.9 29.26 4.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.279 -0.419 . . . . 63.52 110.842 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 210' ' ' ALA . . . . . 0.45 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.43 145.65 26.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.277 -0.42 . . . . 62.23 111.134 179.912 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 211' ' ' VAL . . . . . 0.415 HG21 HG21 ' A' ' 193' ' ' THR . 0.4 OUTLIER -66.91 -27.6 40.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.247 -0.433 . . . . 62.04 111.157 179.986 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 7.4 tpp -96.33 7.98 45.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.185 -0.461 . . . . 75.22 110.844 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 213' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -55.5 110.29 2.15 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.651 0.738 . . . . 73.43 110.962 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.69 -18.54 37.26 Favored 'Trans proline' 0 C--O 1.231 0.158 0 C-N-CA 122.747 2.298 . . . . 63.01 112.356 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 215' ' ' THR . . . . . 0.454 HG23 ' CG2' ' A' ' 61' ' ' ILE . 0.2 OUTLIER -84.24 55.71 3.45 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.224 -0.444 . . . . 74.24 111.152 -179.968 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 6.0 t80 . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 74.14 110.936 -179.895 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 224' ' ' PHE . . . . . 0.4 ' HZ ' ' HG1' ' A' ' 193' ' ' THR . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.934 0.397 . . . . 65.01 110.927 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -143.65 167.14 22.96 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.125 -0.489 . . . . 64.24 110.913 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 226' ' ' LEU . . . . . 0.699 HD13 ' HG3' ' A' ' 119' ' ' GLU . 0.4 OUTLIER -59.79 149.52 30.87 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.223 -0.444 . . . . 53.44 110.96 179.88 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 227' ' ' SER . . . . . 0.464 ' O ' HD12 ' A' ' 231' ' ' ILE . 5.9 t -86.88 158.6 19.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.236 -0.438 . . . . 74.21 110.85 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -65.4 -65.1 0.72 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.129 -0.487 . . . . 74.54 110.933 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -55.42 -26.34 41.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.196 -0.456 . . . . 72.22 110.822 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 230' ' ' ASP . . . . . 0.424 ' HB2' ' HB3' ' A' ' 227' ' ' SER . 33.1 t70 -69.34 -48.4 61.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.231 -0.44 . . . . 74.23 110.872 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 231' ' ' ILE . . . . . 0.797 HG23 ' HB3' ' A' ' 119' ' ' GLU . 8.7 mt -68.49 -42.94 84.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.193 -0.458 . . . . 73.41 111.118 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 7.4 pttt -63.86 -32.38 73.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.137 -0.483 . . . . 65.42 110.85 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -62.95 -49.76 69.51 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.708 -0.758 . . . . 63.43 112.446 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 234' ' ' ILE . . . . . 0.59 HD12 ' SD ' ' A' ' 202' ' ' MET . 9.1 tt -72.97 -31.99 37.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.831 0.348 . . . . 71.54 111.187 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 11.5 mt-30 -70.9 -23.64 62.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.142 -0.481 . . . . 70.33 110.882 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 236' ' ' LYS . . . . . 0.422 ' HE2' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -73.77 -28.46 61.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.175 -0.466 . . . . 51.21 110.865 179.963 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 237' ' ' LEU . . . . . 0.801 HD22 ' HD2' ' A' ' 83' ' ' LYS . 8.4 tt -97.98 -26.5 14.62 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.263 -0.426 . . . . 75.41 110.935 179.954 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 238' ' ' TYR . . . . . 0.446 ' CE1' HD11 ' A' ' 122' ' ' LEU . 15.1 m-85 -92.3 -35.28 13.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.465 . . . . 51.24 110.918 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.234 0 C-N-CA 120.708 -0.758 . . . . 32.22 112.481 179.961 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 22.1 t-105 . . . . . 0 C--O 1.23 0.071 0 CA-C-O 120.746 0.308 . . . . 71.22 110.912 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 71.6 tt0 -73.12 -36.95 66.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.264 -0.425 . . . . 72.51 110.932 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -65.0 -38.42 90.9 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 61.24 110.909 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.27 -39.05 74.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.13 -0.486 . . . . 54.34 111.116 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.421 HE22 HD22 ' A' ' 35' ' ' LEU . 3.3 mt-30 -69.74 -43.0 73.21 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.174 -0.466 . . . . 73.12 110.905 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -66.42 -31.36 72.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.2 -0.454 . . . . 72.4 110.846 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -61.22 -36.27 79.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.168 -0.469 . . . . 75.11 110.934 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.721 HD12 ' HG2' ' A' ' 38' ' ' LYS . 3.1 tm? -71.88 -21.02 61.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.06 -0.518 . . . . 72.51 110.868 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 4.2 ptmt -75.06 -28.84 60.52 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.235 -0.438 . . . . 74.41 110.841 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.7 ptp180 -86.35 -28.11 23.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.295 -0.412 . . . . 74.05 110.851 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -65.05 -18.15 65.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.18 -0.464 . . . . 74.31 110.895 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.601 ' HB3' HG21 ' A' ' 72' ' ' VAL . 7.6 m-85 . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.169 -0.469 . . . . 72.55 110.869 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.456 ' C ' HD12 ' A' ' 35' ' ' LEU . 2.1 pp . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.792 0.329 . . . . 72.52 110.964 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.87 -53.13 61.64 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.198 -0.455 . . . . 73.13 110.981 179.874 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -66.05 -36.89 84.44 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.091 -0.504 . . . . 63.32 111.062 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.721 ' HG2' HD12 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -65.34 -49.34 69.76 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.262 -0.426 . . . . 72.32 110.849 -179.969 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.981 HD11 HD22 ' A' ' 54' ' ' LEU . 4.4 mt -63.64 -35.37 80.31 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.23 -0.441 . . . . 72.11 110.925 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 12.7 tmtt? -59.89 -45.83 91.27 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.19 -0.459 . . . . 62.43 110.877 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 3.2 pt-20 -60.91 -32.77 72.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.191 -0.459 . . . . 75.11 110.913 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 27.0 ttp -68.34 -34.1 75.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 63.43 110.954 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.455 ' CD ' HD11 ' A' ' 48' ' ' LEU . 1.8 mm-40 -59.79 -39.59 85.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 74.45 110.878 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.6 mmpt? -70.56 -30.61 67.38 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.242 -0.436 . . . . 71.43 110.815 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 14.5 t80 -70.4 -42.22 71.95 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.255 -0.43 . . . . 73.32 110.893 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.823 ' CZ ' HD13 ' A' ' 61' ' ' ILE . 7.9 m-85 -82.19 -35.19 28.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.137 -0.483 . . . . 70.43 110.881 -179.886 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.431 ' HA3' ' HB3' ' A' ' 206' ' ' SER . . . 102.45 -7.81 54.32 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.777 -0.725 . . . . 64.34 112.479 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.529 HD23 ' CB ' ' A' ' 46' ' ' PHE . 0.7 OUTLIER -60.07 138.34 91.13 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-O 121.649 0.737 . . . . 64.11 110.869 -179.941 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.82 -52.12 0.34 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.677 2.252 . . . . 74.5 112.329 179.89 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.507 HD12 HG23 ' A' ' 58' ' ' VAL . 0.8 OUTLIER -52.08 108.26 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.202 -0.454 . . . . 71.22 111.161 179.914 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.409 ' HA ' ' HG3' ' A' ' 43' ' ' GLN . 6.8 p -101.86 159.09 15.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.135 -0.484 . . . . 73.25 111.166 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 58.44 18.63 37.54 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.734 -0.746 . . . . 64.24 112.484 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 27.8 mmt -103.98 160.98 14.37 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.803 0.335 . . . . 75.23 110.899 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.981 HD22 HD11 ' A' ' 39' ' ' LEU . 25.8 tp -173.69 86.17 0.05 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.271 -0.422 . . . . 73.4 110.952 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.0 p30 174.72 -28.3 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.141 -0.481 . . . . 44.35 110.862 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 25.5 m -94.44 -100.19 0.15 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.244 -0.435 . . . . 75.25 110.844 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.573 ' O ' HG23 ' A' ' 61' ' ' ILE . 3.3 tpp85 -84.79 -29.06 25.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.122 -0.49 . . . . 61.22 110.887 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.507 HG23 HD12 ' A' ' 50' ' ' ILE . 61.5 t -65.72 -41.03 89.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.153 -0.476 . . . . 70.12 111.092 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.415 HD13 ' HA ' ' A' ' 59' ' ' ILE . 1.0 OUTLIER -75.16 -31.61 24.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.244 -0.435 . . . . 74.43 111.195 179.899 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -59.52 -44.23 93.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 73.45 110.86 179.86 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.823 HD13 ' CZ ' ' A' ' 46' ' ' PHE . 1.3 pp -62.92 -29.03 46.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.149 -0.478 . . . . 74.52 111.12 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' MET . . . . . 0.44 ' N ' HG13 ' A' ' 61' ' ' ILE . 3.6 mmt -69.01 -35.03 76.2 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.215 -0.448 . . . . 74.01 110.852 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -88.56 -26.31 22.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.207 -0.452 . . . . 42.22 110.874 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.3 136.27 38.0 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.556 0.693 . . . . 65.34 110.891 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' PRO . . . . . 0.474 ' HB2' HD22 ' A' ' 156' ' ' LEU . 53.9 Cg_endo -69.74 127.62 14.88 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.621 2.214 . . . . 72.11 112.401 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 5.5 ttm180 -115.02 -88.05 0.58 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.271 -0.422 . . . . 71.51 110.864 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -146.02 156.39 43.45 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.17 -0.468 . . . . 55.3 110.935 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.508 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -98.22 21.05 48.02 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.796 -0.716 . . . . 64.23 112.462 -179.822 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.568 HG21 ' CD2' ' A' ' 198' ' ' HIS . 0.2 OUTLIER -109.79 135.32 20.44 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.627 0.727 . . . . 74.23 111.193 -179.994 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 70' ' ' PRO . . . . . 0.524 ' HD2' HG12 ' A' ' 69' ' ' VAL . 54.7 Cg_endo -69.78 156.24 63.8 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.715 2.277 . . . . 63.44 112.381 179.964 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -105.84 6.28 31.46 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.26 -0.427 . . . . 74.45 110.867 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.601 HG21 ' HB3' ' A' ' 23' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.263 0 CA-C-N 116.197 -0.456 . . . . 53.43 111.053 -179.924 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo . . . . . 0 C--O 1.232 0.191 0 CA-C-O 120.832 0.263 . . . . 71.11 112.351 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.647 ' HD2' HD22 ' A' ' 237' ' ' LEU . 26.2 mttp -92.68 165.47 12.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.229 -0.442 . . . . 64.45 110.891 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' TRP . . . . . 0.431 ' CD1' ' HA ' ' A' ' 200' ' ' LEU . 54.5 m95 -48.66 127.7 14.0 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.191 -0.459 . . . . 73.31 110.981 179.889 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 15.1 t -115.23 -1.37 12.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.301 -0.409 . . . . 65.3 111.218 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 3.6 m -68.15 -175.94 0.66 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.18 -0.464 . . . . 70.34 110.829 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 2.8 mttt -92.8 -25.03 18.33 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.099 -0.501 . . . . 71.12 110.904 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -153.83 142.13 13.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.206 -0.452 . . . . 74.14 111.138 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 58.8 t -116.6 130.22 71.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 72.25 111.167 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.671 HG22 ' HB3' ' A' ' 125' ' ' ARG . 11.7 p -120.01 168.07 11.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.207 -0.452 . . . . 71.01 111.109 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 2.9 p90 -145.38 146.93 31.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.217 -0.447 . . . . 70.51 110.933 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.431 ' CB ' ' HB3' ' A' ' 132' ' ' ALA . 0.5 OUTLIER -146.21 131.67 18.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.104 -0.498 . . . . 71.25 110.914 179.962 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.452 HD13 ' HB ' ' A' ' 136' ' ' ILE . 18.6 mm -74.99 127.2 36.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.138 -0.483 . . . . 72.4 111.096 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.565 HG22 ' SD ' ' A' ' 135' ' ' MET . 6.5 t -86.38 -40.8 14.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.184 -0.462 . . . . 60.2 111.1 179.826 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 32.9 t -157.16 169.52 24.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.449 . . . . 64.24 110.852 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 11.9 p90 -127.45 155.09 44.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.143 -0.481 . . . . 72.25 110.973 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 3.9 t -95.03 141.26 28.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.116 -0.493 . . . . 64.11 111.16 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 3.6 ptm180 -52.62 -18.96 2.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.287 -0.415 . . . . 72.14 110.836 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.31 -37.75 88.07 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.252 -0.431 . . . . 74.13 110.778 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.757 HD22 HG21 ' A' ' 104' ' ' THR . 1.3 mt -138.65 152.94 71.84 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.613 0.72 . . . . 72.52 110.925 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' PRO . . . . . 0.579 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.6 Cg_endo -69.69 151.12 69.41 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.788 2.325 . . . . 73.11 112.354 179.817 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 13.1 t-160 -51.27 -26.28 7.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.253 -0.43 . . . . 74.11 110.875 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.579 HG22 ' HB2' ' A' ' 101' ' ' PRO . 12.2 tt -77.53 -38.06 25.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.175 -0.466 . . . . 74.02 111.084 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 104' ' ' THR . . . . . 0.757 HG21 HD22 ' A' ' 100' ' ' LEU . 3.0 m -69.01 -40.33 78.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.202 -0.454 . . . . 52.11 111.131 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.76 ' O ' HG13 ' A' ' 109' ' ' VAL . 93.5 t -72.16 -46.19 59.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.266 -0.424 . . . . 71.51 111.097 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.662 ' O ' HG22 ' A' ' 109' ' ' VAL . 45.6 t0 -59.35 -45.69 90.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.202 -0.453 . . . . 63.44 110.842 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -70.36 -33.53 71.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.186 -0.461 . . . . 75.02 110.815 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.622 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -60.3 -49.09 78.99 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.246 -0.434 . . . . 71.04 110.888 -179.958 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.76 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.5 m -55.62 -41.49 64.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.153 -0.476 . . . . 72.31 111.045 179.892 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.465 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 37.5 t -70.0 -33.76 72.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.183 -0.462 . . . . 72.14 110.819 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.429 ' CG ' HD21 ' A' ' 189' ' ' LEU . 0.3 OUTLIER -61.92 -33.3 73.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.152 -0.476 . . . . 74.35 110.864 179.954 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -95.87 -40.28 9.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.225 -0.443 . . . . 74.32 111.092 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.696 ' CD1' HD12 ' A' ' 196' ' ' LEU . 0.4 OUTLIER -65.24 -32.9 74.81 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.205 -0.452 . . . . 72.0 110.92 -179.954 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 38.9 t30 -64.66 -35.51 81.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 72.34 110.846 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' MET . . . . . 0.542 ' O ' HD11 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -67.49 -33.79 75.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.174 -0.466 . . . . 54.12 110.862 179.932 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 9.4 m95 -70.58 -52.47 21.36 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.186 -0.461 . . . . 75.23 110.904 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -60.24 -43.61 98.31 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.724 -0.751 . . . . 73.32 112.494 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.97 -19.06 60.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.714 0.292 . . . . 72.42 110.85 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.73 ' HG2' HD13 ' A' ' 226' ' ' LEU . 0.2 OUTLIER -96.29 13.4 27.72 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.235 -0.438 . . . . 75.24 110.886 179.952 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 1.043 HD12 HD12 ' A' ' 122' ' ' LEU . 8.6 pt -146.89 147.04 28.32 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.55 0.691 . . . . 71.34 111.2 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 5.72 1.59 Allowed 'Trans proline' 0 C--O 1.233 0.245 0 C-N-CA 122.655 2.236 . . . . 72.21 112.32 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 1.043 HD12 HD12 ' A' ' 120' ' ' ILE . 10.9 mt -61.12 -160.96 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.2 -0.454 . . . . 73.22 110.894 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 8.7 t-80 -150.67 123.18 8.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.228 -0.442 . . . . 74.12 110.803 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 11.1 m-30 -107.54 148.76 28.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.253 -0.43 . . . . 75.54 110.934 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.671 ' HB3' HG22 ' A' ' 90' ' ' THR . 0.0 OUTLIER -133.03 141.24 48.14 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.153 -0.476 . . . . 75.14 110.843 -179.884 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.8 139.71 35.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 72.22 110.841 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 127' ' ' VAL . . . . . 0.92 HG11 ' HB2' ' A' ' 132' ' ' ALA . 19.1 m -102.91 133.43 46.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.228 -0.442 . . . . 50.13 111.046 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.446 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -146.68 -23.59 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.157 -0.474 . . . . 74.43 111.064 179.936 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 129' ' ' TRP . . . . . 0.446 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -138.59 109.3 6.64 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.195 -0.457 . . . . 71.25 110.961 179.924 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 108.48 -159.37 14.27 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.727 -0.749 . . . . 62.11 112.496 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.75 155.4 18.15 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.734 0.302 . . . . 63.25 111.158 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 132' ' ' ALA . . . . . 0.92 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -112.87 165.33 12.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.225 -0.443 . . . . 51.34 111.104 179.851 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -65.37 -60.31 3.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.25 -0.432 . . . . 75.41 110.85 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 19.3 mt -90.7 129.42 41.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.161 -0.472 . . . . 70.51 111.124 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 135' ' ' MET . . . . . 0.565 ' SD ' HG22 ' A' ' 94' ' ' VAL . 0.0 OUTLIER -107.85 122.97 47.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.136 -0.483 . . . . 72.43 110.869 179.882 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.452 ' HB ' HD13 ' A' ' 93' ' ' ILE . 0.8 OUTLIER -105.64 95.73 4.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.239 -0.437 . . . . 70.04 111.132 179.944 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 137' ' ' GLY . . . . . 0.4 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -130.96 166.62 22.6 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.73 -0.747 . . . . 63.34 112.542 179.851 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 138' ' ' PHE . . . . . 0.499 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 60.3 m-85 -105.28 149.14 26.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.912 0.387 . . . . 74.01 110.848 -179.859 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.617 ' HB1' ' CB ' ' A' ' 143' ' ' HIS . . . 173.89 167.23 0.2 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.116 -0.493 . . . . 71.21 111.105 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 33.3 mtt180 -104.19 173.39 6.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.217 -0.447 . . . . 62.21 110.871 -179.898 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -57.46 -15.3 16.41 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.681 -0.771 . . . . 74.24 112.475 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -100.91 14.17 32.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.85 0.357 . . . . 75.03 111.09 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 143' ' ' HIS . . . . . 0.617 ' CB ' ' HB1' ' A' ' 139' ' ' ALA . 8.9 p80 -68.19 -33.35 74.28 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.249 -0.432 . . . . 71.11 110.881 179.926 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 147.28 47.13 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.765 -0.731 . . . . 45.51 112.491 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -158.82 149.57 20.04 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.763 0.316 . . . . 72.14 110.857 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 146' ' ' SER . . . . . 0.475 ' O ' ' CB ' ' A' ' 147' ' ' TYR . 49.0 p -63.73 99.12 0.21 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.224 -0.444 . . . . 51.25 110.888 -179.777 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 147' ' ' TYR . . . . . 0.475 ' CB ' ' O ' ' A' ' 146' ' ' SER . 0.2 OUTLIER 163.04 121.21 0.0 OUTLIER Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.704 0.764 . . . . 73.4 110.848 -179.874 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.74 138.47 37.95 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.705 2.27 . . . . 74.53 112.372 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 149' ' ' PHE . . . . . 0.44 ' C ' ' H ' ' A' ' 151' ' ' GLY . 7.6 p90 -53.84 -42.38 68.44 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.209 -0.451 . . . . 63.52 110.841 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 75.61 -21.93 0.29 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.184 -0.462 . . . . 63.11 110.927 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 151' ' ' GLY . . . . . 0.44 ' H ' ' C ' ' A' ' 149' ' ' PHE . . . 78.83 -159.49 45.89 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.678 -0.773 . . . . 71.41 112.515 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.67 142.41 48.26 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.711 2.274 . . . . 75.11 112.363 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 153' ' ' GLY . . . . . 0.437 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 104.34 -137.52 13.62 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.752 -0.737 . . . . 70.32 112.522 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 154' ' ' ASN . . . . . 0.437 ' C ' ' O ' ' A' ' 153' ' ' GLY . 3.4 p30 -34.86 141.32 0.06 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.944 0.402 . . . . 73.25 110.826 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 155' ' ' THR . . . . . 0.5 HG23 ' HA2' ' A' ' 68' ' ' GLY . 0.2 OUTLIER 75.22 90.07 0.08 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.15 -0.477 . . . . 44.41 111.16 -179.964 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 156' ' ' LEU . . . . . 0.737 HD21 ' CG2' ' A' ' 186' ' ' ILE . 0.0 OUTLIER -71.9 -59.35 2.79 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.162 -0.472 . . . . 75.02 110.914 179.953 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 157' ' ' ALA . . . . . 0.508 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -161.59 148.82 14.57 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.198 -0.455 . . . . 71.42 111.088 179.779 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 158' ' ' HIS . . . . . 0.403 ' O ' ' HB2' ' A' ' 171' ' ' HIS . 15.4 p-80 -103.47 124.38 48.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.194 -0.457 . . . . 72.02 110.862 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 159' ' ' ALA . . . . . 0.466 ' H ' HG22 ' A' ' 69' ' ' VAL . . . -110.58 159.41 17.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.225 -0.443 . . . . 74.42 111.083 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 14.2 m-85 -112.58 152.24 29.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.217 -0.447 . . . . 75.31 110.88 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 161' ' ' ALA . . . . . 0.68 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -81.67 163.64 53.01 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.591 0.71 . . . . 61.04 111.113 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 162' ' ' PRO . . . . . 0.68 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.6 Cg_endo -69.81 79.28 0.97 Allowed 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.667 2.245 . . . . 74.44 112.354 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -148.87 122.8 1.53 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.752 -0.737 . . . . 61.41 112.504 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 1.1 m 66.43 149.75 0.05 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.803 0.335 . . . . 73.1 111.138 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -52.76 -45.45 60.65 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.687 -0.768 . . . . 74.03 112.474 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 166' ' ' LEU . . . . . 0.457 ' C ' HD23 ' A' ' 166' ' ' LEU . 10.1 tt -64.25 -39.9 94.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.891 0.377 . . . . 65.12 110.993 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -78.79 170.49 54.77 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.788 -0.72 . . . . 43.43 112.439 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 80.46 22.86 61.62 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.765 -0.731 . . . . 74.31 112.457 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 85.5 m-20 -96.32 165.13 12.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.853 0.359 . . . . 63.41 110.886 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.44 130.9 55.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.196 -0.456 . . . . 74.21 111.08 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 171' ' ' HIS . . . . . 0.403 ' HB2' ' O ' ' A' ' 158' ' ' HIS . 25.0 m170 -125.05 158.74 33.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.224 -0.444 . . . . 72.53 110.861 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -140.87 137.73 33.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.252 -0.431 . . . . 71.44 110.884 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 173' ' ' ASP . . . . . 0.421 ' HB3' ' OE1' ' A' ' 176' ' ' GLU . 13.6 t0 -70.85 100.92 2.02 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.133 -0.485 . . . . 74.11 110.861 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.05 -11.45 39.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.173 -0.467 . . . . 72.25 110.903 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -78.79 -16.53 57.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.143 -0.48 . . . . 73.32 110.85 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 176' ' ' GLU . . . . . 0.437 ' CD ' HD13 ' A' ' 156' ' ' LEU . 1.4 mt-10 -90.53 -168.83 2.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.253 -0.431 . . . . 63.2 110.893 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 54.1 mtt85 -115.64 121.49 42.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.162 -0.472 . . . . 63.14 110.869 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 60.4 m95 -116.92 144.42 44.56 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.213 -0.449 . . . . 72.31 110.916 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 179' ' ' THR . . . . . 0.609 ' HA ' HD21 ' A' ' 100' ' ' LEU . 2.5 t -177.0 163.81 2.21 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.224 -0.444 . . . . 74.13 111.139 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -125.07 -70.0 0.77 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.194 -0.457 . . . . 45.33 110.845 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -67.74 -10.8 59.09 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.68 -0.772 . . . . 62.41 112.529 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 182' ' ' SER . . . . . 0.518 ' HB3' HG21 ' A' ' 179' ' ' THR . 0.3 OUTLIER -95.07 -24.54 16.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.914 0.388 . . . . 64.5 110.881 -179.723 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 183' ' ' SER . . . . . 0.464 ' C ' ' O ' ' A' ' 182' ' ' SER . 56.8 m 32.94 66.17 0.21 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.076 -0.511 . . . . 64.12 110.898 -179.79 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 6.4 tp -116.9 -33.61 4.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.162 -0.472 . . . . 74.2 110.885 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -128.91 -128.26 3.04 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.756 -0.735 . . . . 73.01 112.506 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 186' ' ' ILE . . . . . 0.737 ' CG2' HD21 ' A' ' 156' ' ' LEU . 4.6 mm -79.33 97.56 2.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.856 0.36 . . . . 73.22 111.178 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -54.75 121.17 7.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.177 -0.465 . . . . 71.31 110.91 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 188' ' ' PHE . . . . . 0.639 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.3 t80 -54.43 -33.16 58.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.145 -0.479 . . . . 75.45 110.867 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 189' ' ' LEU . . . . . 0.644 HD12 ' CD2' ' A' ' 224' ' ' PHE . 0.1 OUTLIER -67.15 -47.93 69.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.134 -0.484 . . . . 52.02 110.965 -179.986 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 85.7 t80 -70.14 -38.09 75.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.142 -0.481 . . . . 74.22 110.962 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 191' ' ' ALA . . . . . 0.439 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -72.68 -35.4 67.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.098 -0.501 . . . . 50.03 111.027 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 192' ' ' ALA . . . . . 0.672 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -56.8 -44.88 82.38 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.277 -0.42 . . . . 52.11 111.143 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 193' ' ' THR . . . . . 0.587 HG21 ' HE1' ' A' ' 224' ' ' PHE . 0.6 OUTLIER -58.87 -43.04 90.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 72.43 111.177 -179.917 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 11.7 t-160 -72.88 -38.02 67.13 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.166 -0.47 . . . . 71.44 110.861 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -75.5 -47.44 27.02 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.15 -0.477 . . . . 71.01 111.104 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 196' ' ' LEU . . . . . 0.696 HD12 ' CD1' ' A' ' 113' ' ' LEU . 4.6 mm? -63.19 -43.98 96.67 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.234 -0.439 . . . . 74.51 110.864 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -59.14 -28.7 64.43 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.714 -0.755 . . . . 52.23 112.425 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 198' ' ' HIS . . . . . 0.568 ' CD2' HG21 ' A' ' 69' ' ' VAL . 5.1 m-70 -65.69 -32.88 74.68 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.789 0.328 . . . . 75.21 110.817 -179.899 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.57 -21.17 60.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.24 -0.436 . . . . 71.13 110.849 -179.768 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 200' ' ' LEU . . . . . 0.431 ' HA ' ' CD1' ' A' ' 84' ' ' TRP . 0.6 OUTLIER -88.72 2.3 53.61 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.131 -0.486 . . . . 64.13 110.916 179.946 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 84.12 -9.02 64.78 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.718 -0.753 . . . . 50.41 112.446 179.89 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 202' ' ' MET . . . . . . . . . . . . . 37.6 tpp -51.51 138.94 21.2 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.806 0.336 . . . . 63.21 110.855 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -105.12 159.06 15.8 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.744 -0.741 . . . . 64.44 112.53 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 16.0 m-70 -55.52 163.38 1.29 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.813 0.34 . . . . 74.32 110.838 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -123.61 147.81 47.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.184 -0.462 . . . . 53.34 110.834 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 206' ' ' SER . . . . . 0.431 ' HB3' ' HA3' ' A' ' 47' ' ' GLY . 0.7 OUTLIER -88.14 -4.03 58.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.128 -0.487 . . . . 72.22 110.854 -179.81 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -70.99 138.58 85.06 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.626 0.727 . . . . 65.11 110.836 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 -8.96 24.91 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.626 2.217 . . . . 74.53 112.37 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -127.98 29.71 5.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.237 -0.438 . . . . 63.52 110.934 179.956 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 210' ' ' ALA . . . . . 0.457 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.37 145.86 26.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.201 -0.454 . . . . 62.23 111.059 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -67.73 -28.77 42.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.246 -0.434 . . . . 62.04 111.115 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.75 8.84 42.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.149 -0.478 . . . . 75.22 110.908 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 213' ' ' TYR . . . . . 0.411 ' HA ' ' HD2' ' A' ' 214' ' ' PRO . 1.8 t80 -55.73 115.02 8.42 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.703 0.763 . . . . 73.43 110.925 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 214' ' ' PRO . . . . . 0.411 ' HD2' ' HA ' ' A' ' 213' ' ' TYR . 54.3 Cg_endo -69.67 -17.79 37.78 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.711 2.274 . . . . 63.01 112.389 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 215' ' ' THR . . . . . 0.402 ' HB ' ' CE2' ' A' ' 213' ' ' TYR . 0.2 OUTLIER -83.77 55.6 3.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.215 -0.448 . . . . 74.24 111.139 -179.946 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 5.8 t80 . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 116.206 -0.452 . . . . 74.14 110.942 -179.905 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 224' ' ' PHE . . . . . 0.644 ' CD2' HD12 ' A' ' 189' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.925 0.393 . . . . 65.01 110.882 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.75 154.67 43.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 64.24 110.91 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 226' ' ' LEU . . . . . 0.73 HD13 ' HG2' ' A' ' 119' ' ' GLU . 12.0 mt -69.98 148.66 48.62 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.268 -0.424 . . . . 53.44 110.931 179.901 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 227' ' ' SER . . . . . 0.457 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 0.0 OUTLIER -86.65 155.43 20.41 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.154 -0.476 . . . . 74.21 110.861 -179.886 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 42.6 mt-30 -67.45 -66.09 0.6 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.109 -0.496 . . . . 74.54 110.98 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 229' ' ' ASP . . . . . 0.41 ' O ' ' HG2' ' A' ' 232' ' ' LYS . 1.0 OUTLIER -55.74 -26.63 46.48 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.156 -0.474 . . . . 72.22 110.864 179.959 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -69.1 -50.66 46.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.141 -0.481 . . . . 74.23 110.881 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 231' ' ' ILE . . . . . 0.694 HD11 HD22 ' A' ' 226' ' ' LEU . 2.8 mm -70.43 -42.18 78.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.222 -0.445 . . . . 73.41 111.118 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 232' ' ' LYS . . . . . 0.41 ' HG2' ' O ' ' A' ' 229' ' ' ASP . 0.0 OUTLIER -56.47 -32.34 64.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.22 -0.445 . . . . 65.42 110.904 179.84 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -64.55 -50.01 61.53 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.753 -0.737 . . . . 63.43 112.437 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 5.5 tt -73.19 -30.81 32.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.731 0.301 . . . . 71.54 111.089 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -66.38 -24.16 66.45 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.256 -0.429 . . . . 70.33 110.923 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 236' ' ' LYS . . . . . 0.463 ' HE2' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.1 -20.61 60.21 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.239 -0.437 . . . . 51.21 110.904 179.918 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 237' ' ' LEU . . . . . 0.647 HD22 ' HD2' ' A' ' 83' ' ' LYS . 9.8 tt -97.21 -31.38 12.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.217 -0.447 . . . . 75.41 110.935 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 238' ' ' TYR . . . . . 0.456 ' CZ ' HD11 ' A' ' 122' ' ' LEU . 26.4 m-85 -92.16 -35.02 14.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 51.24 110.901 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.336 0 C-N-CA 120.69 -0.767 . . . . 32.22 112.47 -179.988 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.582 ' CH2' HD23 ' A' ' 54' ' ' LEU . 70.0 t-105 . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.678 0.275 . . . . 71.22 110.872 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -72.2 -35.16 68.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.314 -0.403 . . . . 72.51 110.886 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -71.34 -36.51 71.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.113 -0.494 . . . . 61.24 110.946 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.587 ' HB1' ' SD ' ' A' ' 62' ' ' MET . . . -65.82 -44.1 86.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.254 -0.43 . . . . 54.34 111.076 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.571 ' OE1' HD21 ' A' ' 35' ' ' LEU . 0.0 OUTLIER -73.79 -31.92 63.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.264 -0.425 . . . . 73.12 110.865 -179.92 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.506 ' N ' ' HG3' ' A' ' 16' ' ' GLN . 74.5 m-20 -77.72 -31.09 52.05 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.259 -0.428 . . . . 72.4 110.898 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -59.75 -36.32 76.4 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.175 -0.466 . . . . 75.11 110.902 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.449 HD22 ' HA ' ' A' ' 19' ' ' LEU . 0.2 OUTLIER -72.24 -20.99 61.45 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.19 -0.459 . . . . 72.51 110.911 179.998 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 4.2 ptmt -74.0 -27.86 61.17 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.177 -0.465 . . . . 74.41 110.877 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.0 ptp180 -86.34 -27.73 24.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.23 -0.441 . . . . 74.05 110.804 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -60.16 -21.18 61.34 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.219 -0.446 . . . . 74.31 110.859 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.512 ' HB3' HG21 ' A' ' 72' ' ' VAL . 12.5 m-85 . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.134 -0.484 . . . . 72.55 110.952 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.571 HD21 ' OE1' ' A' ' 16' ' ' GLN . 10.8 mp . . . . . 0 C--O 1.23 0.071 0 CA-C-O 120.781 0.325 . . . . 72.52 110.952 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -61.8 -51.47 68.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.166 -0.47 . . . . 73.13 110.913 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -61.48 -50.51 72.47 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.116 -0.493 . . . . 63.32 111.138 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.83 -38.28 81.57 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.152 -0.476 . . . . 72.32 110.92 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.654 HD21 HD22 ' A' ' 54' ' ' LEU . 1.6 mp -61.63 -39.45 91.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.161 -0.472 . . . . 72.11 110.852 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 37.9 mttp -66.22 -46.71 76.25 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.205 -0.452 . . . . 62.43 110.935 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -70.57 -33.04 70.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.188 -0.46 . . . . 75.11 110.903 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.725 ' CE ' HD11 ' A' ' 61' ' ' ILE . 0.0 OUTLIER -67.31 -47.5 70.38 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.164 -0.471 . . . . 63.43 110.884 179.951 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.947 ' HA ' HD12 ' A' ' 48' ' ' LEU . 31.4 mt-30 -59.0 -42.8 90.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.225 -0.443 . . . . 74.45 110.96 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.3 mmpt? -59.6 -27.76 66.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.223 -0.444 . . . . 71.43 110.874 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -70.56 -37.67 74.04 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.24 -0.436 . . . . 73.32 110.834 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.728 ' CD2' HD12 ' A' ' 61' ' ' ILE . 31.3 m-85 -83.94 9.52 12.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.171 -0.468 . . . . 70.43 110.879 -179.863 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.457 ' HA2' ' HB3' ' A' ' 206' ' ' SER . . . 76.55 11.81 84.89 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.782 -0.723 . . . . 64.34 112.474 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.947 HD12 ' HA ' ' A' ' 43' ' ' GLN . 6.1 mt -76.4 121.73 85.44 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.56 0.695 . . . . 64.11 110.952 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.83 -44.77 1.84 Allowed 'Trans proline' 0 C--O 1.231 0.16 0 C-N-CA 122.643 2.229 . . . . 74.5 112.35 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 13.1 pt -58.87 129.67 21.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.193 -0.458 . . . . 71.22 111.144 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 76.5 p -115.2 128.88 56.45 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.127 -0.488 . . . . 73.25 111.179 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 90.95 30.03 11.93 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.746 -0.74 . . . . 64.24 112.45 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' MET . . . . . 0.749 ' O ' HG21 ' A' ' 58' ' ' VAL . 2.6 mmt -130.98 133.91 46.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.873 0.368 . . . . 75.23 110.845 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.654 HD22 HD21 ' A' ' 39' ' ' LEU . 17.3 tp -154.13 95.94 1.89 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.114 -0.493 . . . . 73.4 110.946 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.402 ' HA ' HG13 ' A' ' 59' ' ' ILE . 1.8 t-20 171.01 -26.48 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.198 -0.455 . . . . 44.35 110.93 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 18.6 m -89.38 -99.62 0.09 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.118 -0.492 . . . . 75.25 110.855 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.638 ' O ' HG23 ' A' ' 61' ' ' ILE . 12.2 tpt85 -84.53 -27.42 27.37 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.199 -0.455 . . . . 61.22 110.905 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.749 HG21 ' O ' ' A' ' 53' ' ' MET . 24.8 t -58.06 -44.31 86.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.143 -0.48 . . . . 70.12 111.119 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.402 HG13 ' HA ' ' A' ' 55' ' ' ASN . 9.9 mm -74.55 -30.89 26.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.147 -0.479 . . . . 74.43 111.219 179.885 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -59.2 -35.04 72.89 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.119 -0.491 . . . . 73.45 110.892 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.728 HD12 ' CD2' ' A' ' 46' ' ' PHE . 0.4 OUTLIER -76.12 -29.18 19.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.194 -0.457 . . . . 74.52 111.13 179.951 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 62' ' ' MET . . . . . 0.587 ' SD ' ' HB1' ' A' ' 15' ' ' ALA . 7.0 mtt -61.76 -39.48 91.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.192 -0.458 . . . . 74.01 110.872 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -81.51 -22.73 37.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.22 -0.445 . . . . 42.22 110.873 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.1 mtmt -85.22 126.45 67.31 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.565 0.698 . . . . 65.34 110.95 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.66 140.1 42.22 Favored 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.72 2.28 . . . . 72.11 112.368 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.521 ' O ' HD23 ' A' ' 156' ' ' LEU . 0.2 OUTLIER -134.87 -77.72 0.45 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.254 -0.43 . . . . 71.51 110.901 -179.983 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -145.26 148.81 33.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.469 . . . . 55.3 110.926 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.594 ' HA3' HG22 ' A' ' 155' ' ' THR . . . -106.46 28.31 13.94 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.678 -0.773 . . . . 64.23 112.52 -179.909 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.694 HG21 ' CD2' ' A' ' 198' ' ' HIS . 0.2 OUTLIER -106.12 134.26 19.84 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 121.622 0.725 . . . . 74.23 111.135 -179.97 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 70' ' ' PRO . . . . . 0.467 ' HD2' HG12 ' A' ' 69' ' ' VAL . 54.2 Cg_endo -69.7 132.69 23.96 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.706 2.27 . . . . 63.44 112.326 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -93.29 22.16 5.42 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.245 -0.434 . . . . 74.45 110.887 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.512 HG21 ' HB3' ' A' ' 23' ' ' TYR . 3.1 m . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.154 -0.475 . . . . 53.43 111.124 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo . . . . . 0 C--O 1.231 0.166 0 CA-C-O 120.811 0.255 . . . . 71.11 112.334 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.844 ' HD2' HD22 ' A' ' 237' ' ' LEU . 9.4 mttt -106.56 171.0 7.59 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.189 -0.46 . . . . 64.45 110.954 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 61.0 m95 -56.53 131.15 47.85 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.239 -0.437 . . . . 73.31 110.933 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 4.8 t -115.19 -16.34 11.56 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.172 -0.467 . . . . 65.3 111.089 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 3.3 m -59.06 172.89 0.51 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.247 -0.433 . . . . 70.34 110.887 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 2.8 mptp? -85.04 -21.17 29.51 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.124 -0.489 . . . . 71.12 110.931 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -154.8 143.57 13.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.197 -0.456 . . . . 74.14 111.111 179.836 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 25.7 t -119.64 130.44 74.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.167 -0.47 . . . . 72.25 111.171 179.855 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.671 HG22 ' HB3' ' A' ' 125' ' ' ARG . 43.5 p -115.77 163.53 15.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.471 . . . . 71.01 111.1 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 4.7 p90 -145.96 146.22 30.95 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.207 -0.451 . . . . 70.51 110.923 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 3.7 ttt-85 -151.69 139.09 19.46 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.131 -0.486 . . . . 71.25 110.849 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.522 HD11 ' HA ' ' A' ' 106' ' ' ASP . 11.1 mm -74.84 131.28 35.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.162 -0.472 . . . . 72.4 111.141 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.677 HG22 ' SD ' ' A' ' 135' ' ' MET . 9.3 t -88.6 -40.74 13.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.461 . . . . 60.2 111.183 179.812 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -151.52 169.36 22.27 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.128 -0.487 . . . . 64.24 110.792 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 13.8 p90 -129.63 155.08 46.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.11 -0.496 . . . . 72.25 110.98 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 2.1 t -102.79 141.84 34.92 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.183 -0.462 . . . . 64.11 111.194 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.44 -18.72 1.78 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.27 -0.423 . . . . 72.14 110.866 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -65.16 -37.32 87.0 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.158 -0.474 . . . . 74.13 110.847 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.413 HD21 ' HA ' ' A' ' 179' ' ' THR . 1.3 mp -142.37 152.82 61.62 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.681 0.753 . . . . 72.52 110.858 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 101' ' ' PRO . . . . . 0.59 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.4 Cg_endo -69.76 150.97 68.92 Favored 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 122.689 2.259 . . . . 73.11 112.337 179.883 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 3.7 t-160 -52.7 -25.62 11.53 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.225 -0.443 . . . . 74.11 110.882 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.59 HG22 ' HB2' ' A' ' 101' ' ' PRO . 13.9 tt -77.36 -39.2 27.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.15 -0.477 . . . . 74.02 111.098 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 104' ' ' THR . . . . . 0.78 ' O ' HD22 ' A' ' 108' ' ' LEU . 3.6 m -69.13 -36.21 77.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.18 -0.463 . . . . 52.11 111.181 179.938 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.772 HG13 ' CZ ' ' A' ' 188' ' ' PHE . 60.2 t -71.93 -42.91 68.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.226 -0.443 . . . . 71.51 111.126 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.654 ' O ' HG22 ' A' ' 109' ' ' VAL . 0.0 OUTLIER -67.02 -37.19 83.69 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.171 -0.468 . . . . 63.44 110.845 179.92 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 107' ' ' ARG . . . . . 0.49 ' HG3' ' N ' ' A' ' 108' ' ' LEU . 0.0 OUTLIER -70.72 -33.27 70.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.172 -0.467 . . . . 75.02 110.891 -179.876 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.78 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -66.44 -47.77 72.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.21 -0.45 . . . . 71.04 110.916 -179.978 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.767 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.5 m -55.03 -42.99 67.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.146 -0.479 . . . . 72.31 111.091 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.493 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 30.2 t -70.62 -33.8 71.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.256 -0.429 . . . . 72.14 110.858 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.465 ' HB3' HD21 ' A' ' 189' ' ' LEU . 0.3 OUTLIER -62.02 -33.11 73.76 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.17 -0.468 . . . . 74.35 110.913 179.914 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.7 -40.14 9.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.188 -0.46 . . . . 74.32 111.048 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.695 ' CD1' HD12 ' A' ' 196' ' ' LEU . 0.4 OUTLIER -64.73 -33.26 75.55 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.249 -0.432 . . . . 72.0 110.909 -179.997 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -66.38 -34.89 78.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.183 -0.462 . . . . 72.34 110.861 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' MET . . . . . 0.883 ' HB3' HD23 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -70.24 -33.33 71.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 54.12 110.843 179.927 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 116' ' ' TRP . . . . . 0.602 ' CZ3' HD11 ' A' ' 226' ' ' LEU . 6.3 m95 -70.16 -42.76 72.05 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.232 -0.44 . . . . 75.23 110.898 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -72.89 -40.81 51.21 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.735 -0.745 . . . . 73.32 112.43 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.3 ptpt -61.34 -14.52 27.75 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.802 0.334 . . . . 72.42 110.897 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.641 ' HB3' HG23 ' A' ' 231' ' ' ILE . 41.9 mm-40 -100.69 13.39 35.0 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.241 -0.436 . . . . 75.24 110.838 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 1.133 HD12 HD12 ' A' ' 122' ' ' LEU . 6.6 pt -147.99 144.55 19.12 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.635 0.731 . . . . 71.34 111.099 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.72 24.57 0.17 Allowed 'Trans proline' 0 C--O 1.232 0.221 0 C-N-CA 122.673 2.249 . . . . 72.21 112.367 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 1.133 HD12 HD12 ' A' ' 120' ' ' ILE . 6.3 mt -77.46 -159.71 0.15 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.167 -0.47 . . . . 73.22 110.902 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 4.4 t-80 -151.19 120.98 7.03 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.184 -0.462 . . . . 74.12 110.934 179.852 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 11.0 m-30 -110.36 148.44 31.97 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.224 -0.443 . . . . 75.54 110.891 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.671 ' HB3' HG22 ' A' ' 90' ' ' THR . 0.0 OUTLIER -129.91 141.35 50.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.125 -0.489 . . . . 75.14 110.853 -179.872 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.14 145.25 31.13 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.247 -0.433 . . . . 72.22 110.875 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 127' ' ' VAL . . . . . 1.031 HG11 ' HB2' ' A' ' 132' ' ' ALA . 30.4 m -103.3 126.58 57.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.248 -0.433 . . . . 50.13 111.097 179.861 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.464 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -142.07 -22.62 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.116 -0.493 . . . . 74.43 111.187 179.859 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 129' ' ' TRP . . . . . 0.464 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -140.72 109.15 5.86 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.104 -0.498 . . . . 71.25 110.92 179.92 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.07 -162.24 13.53 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.747 -0.74 . . . . 62.11 112.521 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 3.2 m -101.79 156.61 17.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.79 0.329 . . . . 63.25 111.13 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 132' ' ' ALA . . . . . 1.031 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -111.22 165.2 12.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.218 -0.446 . . . . 51.34 111.136 179.808 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -69.05 -55.33 11.13 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.188 -0.46 . . . . 75.41 110.883 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 134' ' ' ILE . . . . . 0.428 HG22 ' CD1' ' A' ' 136' ' ' ILE . 41.1 mt -82.7 131.06 34.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.196 -0.456 . . . . 70.51 111.12 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 135' ' ' MET . . . . . 0.677 ' SD ' HG22 ' A' ' 94' ' ' VAL . 27.2 mmt -108.06 118.37 36.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.162 -0.472 . . . . 72.43 110.964 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.428 ' CD1' HG22 ' A' ' 134' ' ' ILE . 0.8 OUTLIER -106.16 89.87 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.316 -0.402 . . . . 70.04 111.166 179.955 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 137' ' ' GLY . . . . . 0.402 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -129.53 169.45 20.73 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.774 -0.726 . . . . 63.34 112.509 179.946 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 138' ' ' PHE . . . . . 0.605 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 45.5 m-85 -106.04 147.04 29.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.888 0.375 . . . . 74.01 110.945 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.605 ' HB2' ' O ' ' A' ' 138' ' ' PHE . . . 167.48 166.19 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.142 -0.481 . . . . 71.21 111.105 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.426 ' HB2' ' HB3' ' A' ' 149' ' ' PHE . 1.0 OUTLIER -109.28 174.36 5.9 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.216 -0.447 . . . . 62.21 110.832 -179.939 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 141' ' ' GLY . . . . . 0.547 ' H ' ' HA ' ' A' ' 149' ' ' PHE . . . -54.13 -17.68 8.07 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.783 -0.722 . . . . 74.24 112.461 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 142' ' ' ALA . . . . . 0.534 ' HB2' ' HD2' ' A' ' 149' ' ' PHE . . . -89.36 13.29 13.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.848 0.356 . . . . 75.03 111.159 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 143' ' ' HIS . . . . . 0.451 ' HB3' ' HB1' ' A' ' 139' ' ' ALA . 5.0 p80 -81.09 0.91 33.96 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.191 -0.458 . . . . 71.11 110.859 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 104.61 47.1 1.23 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.828 -0.701 . . . . 45.51 112.521 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -159.46 174.21 15.03 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.795 0.331 . . . . 72.14 110.885 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 57.7 m -63.98 176.42 0.97 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.227 -0.442 . . . . 51.25 110.848 -179.727 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 64.91 121.39 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.599 0.714 . . . . 73.4 110.908 -179.913 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.82 151.29 68.67 Favored 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.627 2.218 . . . . 74.53 112.335 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 149' ' ' PHE . . . . . 0.547 ' HA ' ' H ' ' A' ' 141' ' ' GLY . 1.5 p90 -53.93 -30.22 45.51 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.192 -0.458 . . . . 63.52 110.931 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 150' ' ' ASP . . . . . 0.518 ' CG ' ' O ' ' A' ' 149' ' ' PHE . 2.9 p30 50.03 15.45 0.18 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.135 -0.484 . . . . 63.11 110.851 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 151' ' ' GLY . . . . . 0.407 ' C ' ' O ' ' A' ' 150' ' ' ASP . . . 37.5 -154.64 0.01 OUTLIER Glycine 0 N--CA 1.453 -0.228 0 C-N-CA 120.698 -0.763 . . . . 71.41 112.518 -179.925 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 143.51 51.25 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.627 2.218 . . . . 75.11 112.389 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 153' ' ' GLY . . . . . 0.448 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 105.0 -132.14 10.96 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.809 -0.71 . . . . 70.32 112.493 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 154' ' ' ASN . . . . . 0.448 ' C ' ' O ' ' A' ' 153' ' ' GLY . 2.7 p30 -34.62 142.51 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.954 0.407 . . . . 73.25 110.907 -179.925 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 155' ' ' THR . . . . . 0.594 HG22 ' HA3' ' A' ' 68' ' ' GLY . 0.3 OUTLIER 69.59 110.06 0.05 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.21 -0.45 . . . . 44.41 111.16 -179.921 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 156' ' ' LEU . . . . . 0.985 HD21 HG21 ' A' ' 186' ' ' ILE . 0.6 OUTLIER -87.97 -54.5 4.2 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.15 -0.477 . . . . 75.02 110.947 179.965 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 157' ' ' ALA . . . . . 0.575 ' HB1' ' O ' ' A' ' 171' ' ' HIS . . . -163.84 149.18 10.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.209 -0.451 . . . . 71.42 111.092 179.805 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 33.9 p-80 -108.1 123.36 48.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.2 -0.455 . . . . 72.02 110.771 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 159' ' ' ALA . . . . . 0.45 ' H ' HG22 ' A' ' 69' ' ' VAL . . . -111.05 160.23 17.04 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.154 -0.475 . . . . 74.42 111.152 179.897 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -110.89 150.77 28.71 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.285 -0.416 . . . . 75.31 110.892 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 161' ' ' ALA . . . . . 0.624 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -79.26 162.1 65.27 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.607 0.718 . . . . 61.04 111.116 179.915 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 162' ' ' PRO . . . . . 0.624 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.5 Cg_endo -69.74 77.82 1.04 Allowed 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.704 2.269 . . . . 74.44 112.315 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -135.18 121.5 2.59 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.697 -0.763 . . . . 61.41 112.52 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 62.61 -173.64 0.15 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.817 0.342 . . . . 73.1 111.144 -179.825 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -79.09 -49.79 6.17 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.815 -0.707 . . . . 74.03 112.527 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 166' ' ' LEU . . . . . 0.585 HD23 ' O ' ' A' ' 166' ' ' LEU . 6.1 tt -63.78 -37.17 86.37 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.863 0.363 . . . . 65.12 110.874 -179.893 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -79.18 157.5 42.97 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.725 -0.75 . . . . 43.43 112.454 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 94.42 22.9 23.22 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.719 -0.753 . . . . 74.31 112.542 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 80.6 m-20 -94.4 168.49 10.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.877 0.37 . . . . 63.41 110.789 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -117.11 130.83 56.89 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.124 -0.489 . . . . 74.21 111.042 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 171' ' ' HIS . . . . . 0.575 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 28.1 m170 -126.11 132.14 51.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.2 -0.454 . . . . 72.53 110.85 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 32.3 m-85 -113.75 139.97 48.66 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.214 -0.448 . . . . 71.44 110.876 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 55.3 t0 -71.56 100.25 2.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.112 -0.494 . . . . 74.11 110.831 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.62 -16.53 10.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.227 -0.442 . . . . 72.25 110.823 -179.87 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -78.46 -16.19 57.81 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.208 -0.451 . . . . 73.32 110.806 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -83.59 -174.54 5.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.255 -0.43 . . . . 63.2 110.969 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 12.9 mtm180 -113.23 116.95 30.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.207 -0.451 . . . . 63.14 110.907 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 44.2 m95 -116.86 137.44 52.21 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.235 -0.439 . . . . 72.31 110.897 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 179' ' ' THR . . . . . 0.567 HG21 ' HB3' ' A' ' 182' ' ' SER . 5.0 t -176.58 163.69 2.42 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.219 -0.446 . . . . 74.13 111.143 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -123.99 -68.69 0.85 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.204 -0.453 . . . . 45.33 110.842 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -66.8 -10.84 56.46 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.755 -0.736 . . . . 62.41 112.492 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 182' ' ' SER . . . . . 0.567 ' HB3' HG21 ' A' ' 179' ' ' THR . 0.3 OUTLIER -96.59 -24.32 16.09 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.912 0.387 . . . . 64.5 110.915 -179.781 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 183' ' ' SER . . . . . 0.448 ' C ' ' O ' ' A' ' 182' ' ' SER . 97.4 p 34.02 63.3 0.41 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.131 -0.486 . . . . 64.12 110.825 -179.9 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 24.8 tp -116.91 -33.64 4.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.18 -0.464 . . . . 74.2 110.889 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -124.51 -135.76 4.49 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.699 -0.762 . . . . 73.01 112.484 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 186' ' ' ILE . . . . . 0.985 HG21 HD21 ' A' ' 156' ' ' LEU . 7.1 mm -79.36 100.09 3.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.775 0.322 . . . . 73.22 111.162 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -50.75 123.79 9.72 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.131 -0.486 . . . . 71.31 110.816 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 188' ' ' PHE . . . . . 0.772 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.6 t80 -54.03 -35.42 61.94 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.121 -0.49 . . . . 75.45 110.873 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 189' ' ' LEU . . . . . 0.565 HD12 ' HE2' ' A' ' 224' ' ' PHE . 0.2 OUTLIER -67.27 -47.11 71.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.122 -0.49 . . . . 52.02 110.955 179.964 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.16 -40.86 77.92 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.234 -0.439 . . . . 74.22 110.934 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 191' ' ' ALA . . . . . 0.602 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -70.16 -35.05 73.73 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.128 -0.487 . . . . 50.03 111.079 179.847 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 192' ' ' ALA . . . . . 0.707 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -56.81 -43.24 80.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.216 -0.447 . . . . 52.11 111.102 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 193' ' ' THR . . . . . 0.504 HG21 HG21 ' A' ' 211' ' ' VAL . 0.0 OUTLIER -57.86 -42.63 84.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.21 -0.45 . . . . 72.43 111.117 -179.891 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 5.7 t-160 -73.46 -40.23 64.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.182 -0.463 . . . . 71.44 110.905 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -70.69 -48.85 52.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.139 -0.482 . . . . 71.01 111.059 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 196' ' ' LEU . . . . . 0.707 HD23 ' O ' ' A' ' 192' ' ' ALA . 4.2 mm? -64.04 -46.6 83.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 74.51 110.939 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -55.06 -31.97 56.36 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.74 -0.743 . . . . 52.23 112.429 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 198' ' ' HIS . . . . . 0.694 ' CD2' HG21 ' A' ' 69' ' ' VAL . 4.5 m-70 -65.54 -36.42 83.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.855 0.36 . . . . 75.21 110.826 -179.898 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 29.9 t -67.38 -21.05 65.63 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.187 -0.46 . . . . 71.13 110.871 -179.755 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -90.31 -0.07 57.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.141 -0.482 . . . . 64.13 110.935 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 85.01 -7.89 72.83 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.692 -0.766 . . . . 50.41 112.449 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 202' ' ' MET . . . . . . . . . . . . . 28.3 tpp -50.05 139.36 14.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.797 0.332 . . . . 63.21 110.966 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -101.17 159.08 18.85 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.776 -0.726 . . . . 64.44 112.535 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 204' ' ' HIS . . . . . 0.407 ' HA ' ' HB3' ' A' ' 212' ' ' MET . 22.5 m-70 -56.99 154.81 9.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.791 0.329 . . . . 74.32 110.851 -179.901 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -119.3 145.05 46.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.234 -0.439 . . . . 53.34 110.852 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 206' ' ' SER . . . . . 0.457 ' HB3' ' HA2' ' A' ' 47' ' ' GLY . 1.7 m -87.97 -4.26 58.83 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.155 -0.475 . . . . 72.22 110.805 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 207' ' ' ASP . . . . . 0.411 ' HB2' ' HB2' ' A' ' 210' ' ' ALA . 0.6 OUTLIER -71.38 137.7 83.85 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.635 0.731 . . . . 65.11 110.835 179.998 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -69.71 -9.84 27.11 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.704 2.269 . . . . 74.53 112.368 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 -122.01 24.72 9.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.145 -0.479 . . . . 63.52 110.858 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 210' ' ' ALA . . . . . 0.439 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.33 145.17 26.44 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.185 -0.461 . . . . 62.23 111.092 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 211' ' ' VAL . . . . . 0.504 HG21 HG21 ' A' ' 193' ' ' THR . 0.3 OUTLIER -69.5 -27.71 35.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.185 -0.461 . . . . 62.04 111.163 179.925 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 212' ' ' MET . . . . . 0.407 ' HB3' ' HA ' ' A' ' 204' ' ' HIS . 0.0 OUTLIER -92.1 3.65 54.83 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.205 -0.452 . . . . 75.22 110.841 179.935 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 213' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -55.54 110.43 2.25 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-O 121.652 0.739 . . . . 73.43 110.934 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 -18.07 37.17 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.685 2.257 . . . . 63.01 112.31 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -84.11 58.1 4.57 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.247 -0.433 . . . . 74.24 111.136 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 . . . . . 0 C--N 1.328 -0.351 0 CA-C-N 116.246 -0.434 . . . . 74.14 110.907 -179.938 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 224' ' ' PHE . . . . . 0.565 ' HE2' HD12 ' A' ' 189' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.886 0.374 . . . . 65.01 110.922 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -143.23 -167.74 2.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.109 -0.496 . . . . 64.24 110.905 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 226' ' ' LEU . . . . . 0.883 HD23 ' HB3' ' A' ' 115' ' ' MET . 0.5 OUTLIER -59.3 148.67 31.32 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.208 -0.451 . . . . 53.44 110.902 179.935 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 227' ' ' SER . . . . . 0.439 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 2.0 t -87.12 157.4 19.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.192 -0.458 . . . . 74.21 110.926 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -63.44 -63.07 1.28 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.12 -0.491 . . . . 74.54 110.871 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -55.74 -27.77 52.4 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.212 -0.449 . . . . 72.22 110.897 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.22 -48.51 61.76 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.275 -0.42 . . . . 74.23 110.805 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 231' ' ' ILE . . . . . 0.665 HD11 ' HB3' ' A' ' 226' ' ' LEU . 8.3 mt -68.23 -43.07 84.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.213 -0.449 . . . . 73.41 111.1 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 11.8 pttp -66.09 -33.03 74.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.157 -0.474 . . . . 65.42 110.91 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -63.18 -46.78 92.41 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.784 -0.722 . . . . 63.43 112.435 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 7.0 tt -72.9 -30.77 33.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.74 0.305 . . . . 71.54 111.066 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -65.87 -24.3 66.84 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.214 -0.448 . . . . 70.33 110.862 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 236' ' ' LYS . . . . . 0.405 ' HE2' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.64 -28.29 60.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.259 -0.428 . . . . 51.21 110.913 179.992 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 237' ' ' LEU . . . . . 0.844 HD22 ' HD2' ' A' ' 83' ' ' LYS . 7.0 tt -97.77 -31.0 12.46 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.2 -0.455 . . . . 75.41 110.892 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 238' ' ' TYR . . . . . 0.417 ' OH ' HD11 ' A' ' 122' ' ' LEU . 3.7 m-85 -91.85 -35.21 14.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.19 -0.459 . . . . 51.24 110.875 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.248 0 C-N-CA 120.691 -0.766 . . . . 32.22 112.453 179.974 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 3.4 t-105 . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.786 0.327 . . . . 71.22 110.917 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 41.1 mm-40 -71.17 -35.49 71.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.271 -0.422 . . . . 72.51 110.926 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 5.8 mm-40 -68.85 -37.13 78.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.098 -0.501 . . . . 61.24 110.88 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.459 ' HB1' ' HE3' ' A' ' 62' ' ' MET . . . -57.21 -36.95 71.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.2 -0.454 . . . . 54.34 111.059 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.507 ' OE1' HD22 ' A' ' 35' ' ' LEU . 42.0 tt0 -69.87 -42.96 72.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.21 -0.45 . . . . 73.12 110.931 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.413 ' HA ' ' HD2' ' A' ' 20' ' ' LYS . 35.6 m-20 -65.21 -31.56 72.79 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.46 . . . . 72.4 110.808 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 17.5 m-85 -70.42 -36.6 74.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.214 -0.448 . . . . 75.11 110.979 -179.836 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.634 HD13 ' O ' ' A' ' 19' ' ' LEU . 3.2 tm? -72.01 -26.32 62.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.063 -0.517 . . . . 72.51 110.923 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.413 ' HD2' ' HA ' ' A' ' 17' ' ' ASP . 5.0 ptmt -67.6 -32.18 72.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.175 -0.466 . . . . 74.41 110.882 179.86 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.8 ptp85 -85.91 -26.74 25.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.251 -0.432 . . . . 74.05 110.82 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -74.51 2.36 9.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.255 -0.429 . . . . 74.31 110.868 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.544 ' CE2' HG11 ' A' ' 72' ' ' VAL . 60.3 t80 . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.154 -0.475 . . . . 72.55 110.947 -179.818 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.507 HD22 ' OE1' ' A' ' 16' ' ' GLN . 31.1 tp . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.733 0.302 . . . . 72.52 110.861 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -57.64 -46.06 84.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.295 -0.412 . . . . 73.13 110.821 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.56 -36.68 84.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.133 -0.485 . . . . 63.32 111.108 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.519 ' HE3' HD12 ' A' ' 19' ' ' LEU . 11.8 mtmt -70.38 -49.31 50.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.171 -0.468 . . . . 72.32 110.845 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.487 HD11 HD22 ' A' ' 54' ' ' LEU . 5.1 mt -59.79 -35.77 75.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.287 -0.415 . . . . 72.11 110.881 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.1 ttmt -58.15 -46.25 85.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.198 -0.455 . . . . 62.43 110.912 179.813 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -70.37 -36.4 74.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 75.11 110.869 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.9 ttp -69.4 -36.48 76.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.173 -0.467 . . . . 63.43 110.849 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.597 ' HG2' HD11 ' A' ' 48' ' ' LEU . 3.2 mt-30 -66.91 -43.34 83.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.166 -0.47 . . . . 74.45 110.987 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.558 ' HD2' ' N ' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -73.11 -20.83 60.85 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.191 -0.459 . . . . 71.43 110.921 179.886 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.558 ' N ' ' HD2' ' A' ' 44' ' ' LYS . 89.1 t80 -71.22 -37.6 72.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.241 -0.436 . . . . 73.32 110.945 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.833 ' CZ ' HD13 ' A' ' 61' ' ' ILE . 6.1 m-85 -81.91 -28.4 32.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.109 -0.496 . . . . 70.43 110.841 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 106.45 -10.44 42.48 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.723 -0.751 . . . . 64.34 112.538 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.597 HD11 ' HG2' ' A' ' 43' ' ' GLN . 0.9 OUTLIER -63.47 138.61 97.41 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.65 0.738 . . . . 64.11 110.863 -179.858 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.84 -54.04 0.24 Allowed 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.664 2.243 . . . . 74.5 112.38 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.689 HD11 ' HB3' ' A' ' 57' ' ' ARG . 0.7 OUTLIER -50.08 107.97 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.24 -0.436 . . . . 71.22 111.074 179.931 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 3.6 p -111.0 167.07 10.53 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.197 -0.456 . . . . 73.25 111.174 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 57.68 19.59 35.99 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.739 -0.743 . . . . 64.24 112.538 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.1 mtt -119.55 161.09 21.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.795 0.331 . . . . 75.23 110.883 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.487 HD22 HD11 ' A' ' 39' ' ' LEU . 26.2 tp -164.35 85.38 0.44 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.27 -0.423 . . . . 73.4 110.99 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.424 ' HA ' HG13 ' A' ' 59' ' ' ILE . 0.9 OUTLIER 175.52 -29.17 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.188 -0.46 . . . . 44.35 110.86 179.907 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 23.5 m -89.77 -101.29 0.1 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.235 -0.439 . . . . 75.25 110.811 -179.826 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.689 ' HB3' HD11 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -84.79 -28.54 26.09 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.125 -0.489 . . . . 61.22 110.927 -179.944 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.654 HG23 HD12 ' A' ' 50' ' ' ILE . 43.6 t -64.63 -42.69 95.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.125 -0.489 . . . . 70.12 111.12 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.424 HG13 ' HA ' ' A' ' 55' ' ' ASN . 1.5 mm -74.61 -31.43 27.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.161 -0.472 . . . . 74.43 111.127 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -58.97 -40.16 83.93 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.15 -0.477 . . . . 73.45 110.913 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.833 HD13 ' CZ ' ' A' ' 46' ' ' PHE . 1.2 pp -68.17 -28.98 42.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.088 -0.505 . . . . 74.52 111.124 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' MET . . . . . 0.459 ' HE3' ' HB1' ' A' ' 15' ' ' ALA . 3.3 mmt -60.54 -40.19 90.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.182 -0.463 . . . . 74.01 110.891 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -84.46 -23.76 29.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.219 -0.446 . . . . 42.22 110.892 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.37 112.1 41.59 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.533 0.682 . . . . 65.34 110.873 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 151.8 69.12 Favored 'Trans proline' 0 N--CA 1.465 -0.188 0 C-N-CA 122.707 2.271 . . . . 72.11 112.367 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -145.75 -68.84 0.28 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.217 -0.447 . . . . 71.51 110.843 -179.939 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -145.21 151.89 39.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.243 -0.435 . . . . 55.3 110.889 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.652 ' HA2' HG23 ' A' ' 155' ' ' THR . . . -88.02 4.27 85.59 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.742 -0.742 . . . . 64.23 112.495 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.49 HG21 ' CD2' ' A' ' 198' ' ' HIS . 0.2 OUTLIER -92.89 135.24 26.28 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.645 0.735 . . . . 74.23 111.111 -179.912 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 70' ' ' PRO . . . . . 0.486 ' HD2' HG12 ' A' ' 69' ' ' VAL . 53.6 Cg_endo -69.78 151.93 69.1 Favored 'Trans proline' 0 C--O 1.231 0.143 0 C-N-CA 122.679 2.253 . . . . 63.44 112.321 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -58.91 -30.86 68.13 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.166 -0.47 . . . . 74.45 110.864 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.544 HG11 ' CE2' ' A' ' 23' ' ' TYR . 8.9 m . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.208 -0.451 . . . . 53.43 111.111 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 C--O 1.232 0.181 0 CA-C-O 120.855 0.273 . . . . 71.11 112.319 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.644 ' HD2' HD22 ' A' ' 237' ' ' LEU . 20.4 mttp -78.31 161.16 27.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.263 -0.426 . . . . 64.45 110.849 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' TRP . . . . . 0.432 ' CD1' ' HA ' ' A' ' 200' ' ' LEU . 27.2 m95 -49.88 116.42 1.8 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.217 -0.447 . . . . 73.31 110.906 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.434 HG22 ' O ' ' A' ' 85' ' ' THR . 6.4 m -115.17 1.05 13.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.262 -0.427 . . . . 65.3 111.132 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.8 m -66.33 -176.61 0.45 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.197 -0.456 . . . . 70.34 110.842 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 4.0 mttt -92.07 -23.08 19.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.102 -0.499 . . . . 71.12 110.94 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -154.29 143.49 13.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.226 -0.443 . . . . 74.14 111.064 179.866 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 99.6 t -117.81 130.36 72.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.142 -0.481 . . . . 72.25 111.119 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.644 HG22 ' HB3' ' A' ' 125' ' ' ARG . 28.8 p -122.09 162.34 21.42 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.16 -0.473 . . . . 71.01 111.157 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 4.0 p90 -151.24 146.59 26.17 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.223 -0.444 . . . . 70.51 110.932 -179.877 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 10.4 ttt180 -148.36 135.88 20.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.124 -0.489 . . . . 71.25 110.899 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.405 HG13 ' HB ' ' A' ' 136' ' ' ILE . 3.9 mp -74.82 135.46 27.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.205 -0.452 . . . . 72.4 111.173 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.417 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 19.9 t -90.33 -40.48 12.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.19 -0.459 . . . . 60.2 111.105 179.909 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 40.9 t -144.16 164.45 30.65 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.174 -0.466 . . . . 64.24 110.863 -179.802 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 6.1 p90 -111.47 153.41 26.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.159 -0.473 . . . . 72.25 110.958 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.486 ' OG1' HG21 ' A' ' 105' ' ' VAL . 0.2 OUTLIER -82.61 140.97 32.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.128 -0.487 . . . . 64.11 111.136 -179.949 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 10.8 ptp180 -73.21 -7.88 53.38 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.214 -0.448 . . . . 72.14 110.893 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -96.42 -26.05 15.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.232 -0.44 . . . . 74.13 110.927 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.614 HD21 ' HA ' ' A' ' 179' ' ' THR . 0.5 OUTLIER -133.55 153.75 80.44 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.57 0.7 . . . . 72.52 110.928 -179.936 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 101' ' ' PRO . . . . . 0.603 ' HB2' HG22 ' A' ' 103' ' ' ILE . 54.5 Cg_endo -69.7 150.9 69.16 Favored 'Trans proline' 0 N--CA 1.465 -0.187 0 C-N-CA 122.744 2.296 . . . . 73.11 112.359 179.825 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 16.3 t-160 -53.22 -25.79 15.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.304 -0.407 . . . . 74.11 110.817 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.603 HG22 ' HB2' ' A' ' 101' ' ' PRO . 15.2 tt -76.62 -39.15 31.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.449 . . . . 74.02 111.119 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 104' ' ' THR . . . . . 0.664 ' O ' HD22 ' A' ' 108' ' ' LEU . 3.3 m -69.2 -38.91 78.86 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.166 -0.47 . . . . 52.11 111.157 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.733 ' O ' HG13 ' A' ' 109' ' ' VAL . 97.3 t -72.72 -44.85 58.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.172 -0.467 . . . . 71.51 111.111 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.685 ' O ' HG22 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -66.27 -41.79 89.39 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.257 -0.429 . . . . 63.44 110.851 179.893 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -70.04 -34.23 72.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 75.02 110.909 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.664 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -61.05 -48.1 83.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.162 -0.472 . . . . 71.04 110.935 -179.991 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.733 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.4 m -55.37 -41.37 61.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.218 -0.446 . . . . 72.31 111.095 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.463 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 32.1 t -70.08 -33.8 72.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.17 -0.468 . . . . 72.14 110.894 -179.807 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.41 ' CG ' HD21 ' A' ' 189' ' ' LEU . 0.3 OUTLIER -62.28 -33.26 74.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.09 -0.504 . . . . 74.35 110.873 179.951 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -95.68 -40.53 9.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.219 -0.446 . . . . 74.32 111.114 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.722 ' CD1' HD12 ' A' ' 196' ' ' LEU . 0.4 OUTLIER -65.32 -32.8 74.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.263 -0.426 . . . . 72.0 110.954 -179.984 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 15.4 t30 -65.49 -39.85 92.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.172 -0.467 . . . . 72.34 110.887 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' MET . . . . . 0.777 ' O ' HD11 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -59.85 -34.95 73.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.107 -0.497 . . . . 54.12 110.868 179.951 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 116' ' ' TRP . . . . . 0.429 ' CG ' HD11 ' A' ' 200' ' ' LEU . 28.2 m95 -66.59 -52.28 47.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.282 -0.417 . . . . 75.23 110.947 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -60.13 -36.17 89.79 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.754 -0.736 . . . . 73.32 112.45 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.3 mmpt? -64.67 -14.09 56.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.724 0.297 . . . . 72.42 110.95 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.457 ' HG2' HG23 ' A' ' 120' ' ' ILE . 0.6 OUTLIER -99.11 -13.81 19.64 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.226 -0.443 . . . . 75.24 110.873 179.974 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 1.12 HD12 HD12 ' A' ' 122' ' ' LEU . 6.9 pt -122.79 142.92 38.95 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.619 0.723 . . . . 71.34 111.121 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.8 8.54 0.75 Allowed 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.708 2.272 . . . . 72.21 112.364 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 1.12 HD12 HD12 ' A' ' 120' ' ' ILE . 16.4 mt -61.26 -163.17 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.216 -0.447 . . . . 73.22 110.938 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 123' ' ' HIS . . . . . 0.401 ' H ' ' HB3' ' A' ' 122' ' ' LEU . 12.2 t-80 -144.87 122.98 12.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.196 -0.457 . . . . 74.12 110.861 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 9.2 m-30 -107.49 141.47 38.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 75.54 110.86 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.644 ' HB3' HG22 ' A' ' 90' ' ' THR . 0.0 OUTLIER -125.93 141.63 51.88 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.164 -0.471 . . . . 75.14 110.911 -179.931 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.85 152.5 28.15 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.263 -0.426 . . . . 72.22 110.876 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 127' ' ' VAL . . . . . 0.893 HG11 ' HB2' ' A' ' 132' ' ' ALA . 29.3 m -103.17 126.24 57.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.176 -0.466 . . . . 50.13 111.137 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.606 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -144.9 -11.08 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.151 -0.477 . . . . 74.43 111.126 179.994 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 129' ' ' TRP . . . . . 0.606 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -157.0 109.24 2.46 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.166 -0.47 . . . . 71.25 110.869 -179.996 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 108.22 -162.49 13.06 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.726 -0.749 . . . . 62.11 112.505 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.88 156.35 17.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.79 0.328 . . . . 63.25 111.132 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 132' ' ' ALA . . . . . 0.893 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -111.62 165.28 12.15 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.196 -0.456 . . . . 51.34 111.109 179.852 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -73.41 -55.1 6.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 75.41 110.819 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 134' ' ' ILE . . . . . 0.439 HD12 ' N ' ' A' ' 134' ' ' ILE . 4.8 mp -92.68 107.48 19.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.205 -0.452 . . . . 70.51 111.143 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 135' ' ' MET . . . . . 0.417 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 14.0 mmm -91.54 128.18 37.27 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.207 -0.451 . . . . 72.43 110.887 179.849 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.405 ' HB ' HG13 ' A' ' 93' ' ' ILE . 0.6 OUTLIER -106.13 94.74 3.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.263 -0.426 . . . . 70.04 111.098 179.976 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -134.59 160.56 24.27 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.732 -0.747 . . . . 63.34 112.47 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 138' ' ' PHE . . . . . 0.571 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 49.2 m-85 -105.08 149.53 25.76 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.82 0.343 . . . . 74.01 110.912 -179.887 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.571 ' HB2' ' O ' ' A' ' 138' ' ' PHE . . . 169.43 166.83 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.203 -0.453 . . . . 71.21 111.074 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -104.44 173.27 6.38 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.189 -0.459 . . . . 62.21 110.928 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -55.36 -17.1 11.2 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.72 -0.753 . . . . 74.24 112.524 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -88.3 12.93 12.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.829 0.347 . . . . 75.03 111.109 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 5.9 p80 -80.67 -22.11 40.73 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.184 -0.462 . . . . 71.11 110.939 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 139.34 38.7 0.1 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.808 -0.71 . . . . 45.51 112.495 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 54.1 p-10 -150.18 152.01 33.98 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.823 0.344 . . . . 72.14 110.869 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 96.0 p -73.4 -179.74 3.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.175 -0.466 . . . . 51.25 110.861 -179.747 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 68.6 121.08 0.03 OUTLIER Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.659 0.742 . . . . 73.4 110.897 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.75 144.88 55.52 Favored 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 122.665 2.243 . . . . 74.53 112.391 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 149' ' ' PHE . . . . . 0.424 ' CE1' ' HB2' ' A' ' 173' ' ' ASP . 0.1 OUTLIER -90.89 -32.78 15.89 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.182 -0.463 . . . . 63.52 110.926 -179.975 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 73.88 -1.26 3.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.158 -0.474 . . . . 63.11 110.859 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 49.58 -108.37 0.44 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.809 -0.71 . . . . 71.41 112.504 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.84 139.61 40.37 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.58 2.186 . . . . 75.11 112.419 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 103.23 -155.16 18.08 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.745 -0.741 . . . . 70.32 112.497 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 154' ' ' ASN . . . . . 0.436 ' O ' ' CB ' ' A' ' 155' ' ' THR . 2.9 p30 -42.06 153.75 0.06 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.989 0.423 . . . . 73.25 110.857 -179.834 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 155' ' ' THR . . . . . 0.652 HG23 ' HA2' ' A' ' 68' ' ' GLY . 1.2 m 80.15 114.53 0.06 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.149 -0.478 . . . . 44.41 111.155 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 156' ' ' LEU . . . . . 1.085 HD21 HG21 ' A' ' 186' ' ' ILE . 0.7 OUTLIER -99.72 -51.64 3.68 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.255 -0.43 . . . . 75.02 110.984 179.928 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 157' ' ' ALA . . . . . 0.552 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -163.4 148.11 11.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.176 -0.465 . . . . 71.42 111.12 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 21.3 p-80 -108.13 124.92 50.98 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.257 -0.428 . . . . 72.02 110.873 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 159' ' ' ALA . . . . . 0.446 ' H ' HG22 ' A' ' 69' ' ' VAL . . . -110.73 156.26 21.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.239 -0.437 . . . . 74.42 111.065 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 13.0 m-30 -117.05 150.89 37.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.208 -0.451 . . . . 75.31 110.864 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 161' ' ' ALA . . . . . 0.71 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -79.87 164.55 52.52 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 121.591 0.71 . . . . 61.04 111.078 179.907 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 162' ' ' PRO . . . . . 0.71 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.7 Cg_endo -69.76 78.38 1.01 Allowed 'Trans proline' 0 C--N 1.341 0.156 0 C-N-CA 122.707 2.271 . . . . 74.44 112.316 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -140.29 128.55 3.88 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.722 -0.752 . . . . 61.41 112.507 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 64.64 -169.96 0.2 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.848 0.356 . . . . 73.1 111.113 -179.87 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -85.63 -49.86 4.2 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.727 -0.749 . . . . 74.03 112.483 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 166' ' ' LEU . . . . . 0.648 HD23 ' O ' ' A' ' 166' ' ' LEU . 8.2 tt -68.14 -27.52 66.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.869 0.366 . . . . 65.12 110.947 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -84.04 159.92 36.34 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.801 -0.714 . . . . 43.43 112.467 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 88.26 23.07 38.69 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.766 -0.731 . . . . 74.31 112.498 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 -101.14 164.4 11.81 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.862 0.363 . . . . 63.41 110.83 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.13 130.44 55.9 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.16 -0.473 . . . . 74.21 111.118 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 171' ' ' HIS . . . . . 0.439 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 21.2 m170 -125.9 158.54 34.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.242 -0.435 . . . . 72.53 110.81 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -139.45 139.09 36.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.176 -0.466 . . . . 71.44 110.898 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 173' ' ' ASP . . . . . 0.424 ' HB2' ' CE1' ' A' ' 149' ' ' PHE . 67.1 t0 -67.65 97.61 0.63 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.165 -0.47 . . . . 74.11 110.863 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.05 -16.05 11.44 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.137 -0.483 . . . . 72.25 110.905 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -79.16 -16.42 56.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.135 -0.484 . . . . 73.32 110.832 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 37.2 mm-40 -83.17 -173.66 4.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.158 -0.474 . . . . 63.2 110.927 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 78.7 mtt180 -110.33 110.92 21.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.222 -0.445 . . . . 63.14 110.935 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 68.1 m95 -110.86 134.39 52.58 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.196 -0.456 . . . . 72.31 110.957 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 179' ' ' THR . . . . . 0.614 ' HA ' HD21 ' A' ' 100' ' ' LEU . 7.4 t -177.28 163.62 2.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.225 -0.443 . . . . 74.13 111.077 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -125.22 -70.25 0.75 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.165 -0.471 . . . . 45.33 110.847 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -63.06 -13.42 48.43 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.804 -0.712 . . . . 62.41 112.529 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 182' ' ' SER . . . . . 0.508 ' HB3' HG21 ' A' ' 179' ' ' THR . 0.3 OUTLIER -93.1 -24.44 18.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.885 0.374 . . . . 64.5 110.89 -179.739 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 183' ' ' SER . . . . . 0.418 ' C ' ' O ' ' A' ' 182' ' ' SER . 89.5 p 36.04 58.53 0.95 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 64.12 110.866 -179.814 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -116.85 -33.48 4.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.154 -0.475 . . . . 74.2 110.894 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -119.52 -138.58 5.76 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.713 -0.756 . . . . 73.01 112.491 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 186' ' ' ILE . . . . . 1.085 HG21 HD21 ' A' ' 156' ' ' LEU . 9.2 mm -79.49 102.98 5.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 120.798 0.332 . . . . 73.22 111.115 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -48.96 119.54 3.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.202 -0.454 . . . . 71.31 110.866 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 188' ' ' PHE . . . . . 0.589 ' HD2' ' HB3' ' A' ' 108' ' ' LEU . 1.3 t80 -53.94 -33.72 57.59 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.172 -0.467 . . . . 75.45 110.914 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 189' ' ' LEU . . . . . 0.592 HD12 ' CD2' ' A' ' 224' ' ' PHE . 0.1 OUTLIER -67.1 -47.49 71.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.101 -0.499 . . . . 52.02 110.995 179.955 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.42 -42.54 74.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.16 -0.473 . . . . 74.22 110.927 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 191' ' ' ALA . . . . . 0.524 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -68.92 -35.28 76.63 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.125 -0.489 . . . . 50.03 111.124 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 192' ' ' ALA . . . . . 0.655 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -56.84 -43.08 80.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.256 -0.429 . . . . 52.11 111.071 179.886 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 193' ' ' THR . . . . . 0.788 HG21 HG21 ' A' ' 211' ' ' VAL . 0.2 OUTLIER -57.65 -41.45 81.47 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.208 -0.451 . . . . 72.43 111.113 -179.851 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 5.3 t-160 -73.34 -45.62 54.06 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.207 -0.451 . . . . 71.44 110.888 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -67.49 -48.91 65.74 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.157 -0.474 . . . . 71.01 111.057 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 196' ' ' LEU . . . . . 0.722 HD12 ' CD1' ' A' ' 113' ' ' LEU . 4.2 mm? -66.31 -37.36 85.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.293 -0.412 . . . . 74.51 110.924 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 197' ' ' GLY . . . . . 0.405 ' O ' ' HB3' ' A' ' 202' ' ' MET . . . -65.4 -28.49 73.64 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.744 -0.741 . . . . 52.23 112.461 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 198' ' ' HIS . . . . . 0.49 ' CD2' HG21 ' A' ' 69' ' ' VAL . 4.0 m-70 -66.87 -37.9 85.29 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.84 0.352 . . . . 75.21 110.873 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -64.46 -20.92 66.48 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.218 -0.446 . . . . 71.13 110.808 -179.764 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 200' ' ' LEU . . . . . 0.432 ' HA ' ' CD1' ' A' ' 84' ' ' TRP . 0.6 OUTLIER -88.5 0.63 56.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.216 -0.447 . . . . 64.13 110.854 -179.969 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 84.1 -6.34 75.88 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.807 -0.711 . . . . 50.41 112.452 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 202' ' ' MET . . . . . 0.406 ' HE1' ' HB ' ' A' ' 234' ' ' ILE . 36.5 tpp -50.27 139.27 15.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.877 0.37 . . . . 63.21 110.798 -180.0 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -103.26 158.98 17.3 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.751 -0.738 . . . . 64.44 112.438 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 27.3 m-70 -58.22 150.96 20.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.784 0.326 . . . . 74.32 110.881 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -116.39 146.87 42.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.261 -0.427 . . . . 53.34 110.814 -179.754 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 88.7 p -87.96 -4.74 58.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.106 -0.497 . . . . 72.22 110.889 -179.868 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.64 136.47 83.26 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.61 0.719 . . . . 65.11 110.849 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.75 -8.21 23.02 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.681 2.254 . . . . 74.53 112.417 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -122.92 23.02 9.5 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.16 -0.473 . . . . 63.52 110.948 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 210' ' ' ALA . . . . . 0.444 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.25 145.81 26.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.08 -0.509 . . . . 62.23 111.102 179.841 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 211' ' ' VAL . . . . . 0.788 HG21 HG21 ' A' ' 193' ' ' THR . 0.4 OUTLIER -69.55 -29.01 39.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.229 -0.441 . . . . 62.04 111.132 179.983 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -93.53 10.36 32.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.151 -0.477 . . . . 75.22 110.882 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 213' ' ' TYR . . . . . 0.407 ' HA ' ' HD2' ' A' ' 214' ' ' PRO . 2.3 t80 -55.56 114.68 7.74 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-O 121.699 0.761 . . . . 73.43 110.958 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 214' ' ' PRO . . . . . 0.407 ' HD2' ' HA ' ' A' ' 213' ' ' TYR . 53.5 Cg_endo -69.76 -20.0 35.41 Favored 'Trans proline' 0 C--O 1.232 0.211 0 C-N-CA 122.639 2.226 . . . . 63.01 112.315 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -86.45 49.18 1.75 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.255 -0.43 . . . . 74.24 111.128 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 6.5 t80 . . . . . 0 C--N 1.328 -0.357 0 CA-C-N 116.251 -0.431 . . . . 74.14 110.937 -179.935 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 224' ' ' PHE . . . . . 0.592 ' CD2' HD12 ' A' ' 189' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.935 0.398 . . . . 65.01 110.866 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -143.19 163.01 34.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.165 -0.47 . . . . 64.24 110.941 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 226' ' ' LEU . . . . . 0.777 HD11 ' O ' ' A' ' 115' ' ' MET . 14.9 mt -61.77 148.99 41.23 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.276 -0.42 . . . . 53.44 110.968 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 227' ' ' SER . . . . . 0.444 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 0.3 OUTLIER -86.95 148.33 25.38 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.237 -0.438 . . . . 74.21 110.787 -179.836 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -60.5 -68.71 0.27 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.14 -0.482 . . . . 74.54 110.935 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.48 -25.42 36.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.217 -0.447 . . . . 72.22 110.828 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -68.89 -48.31 63.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.196 -0.456 . . . . 74.23 110.86 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 231' ' ' ILE . . . . . 0.678 HD11 ' HB3' ' A' ' 226' ' ' LEU . 8.0 mt -68.55 -42.67 83.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.236 -0.438 . . . . 73.41 111.096 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 14.0 ptmt -64.73 -32.38 74.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.242 -0.435 . . . . 65.42 110.889 179.826 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -62.9 -50.07 66.96 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.767 -0.73 . . . . 63.43 112.475 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 234' ' ' ILE . . . . . 0.406 ' HB ' ' HE1' ' A' ' 202' ' ' MET . 0.3 OUTLIER -73.15 -30.5 31.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.862 0.363 . . . . 71.54 111.195 179.98 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 15.3 mt-30 -67.13 -24.28 65.9 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.136 -0.483 . . . . 70.33 110.984 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 236' ' ' LYS . . . . . 0.418 ' HE2' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.09 -26.59 60.45 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.143 -0.481 . . . . 51.21 110.874 179.937 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 237' ' ' LEU . . . . . 0.663 ' O ' HD23 ' A' ' 237' ' ' LEU . 8.1 tt -97.63 -28.94 13.7 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.22 -0.445 . . . . 75.41 110.949 179.903 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 238' ' ' TYR . . . . . 0.538 ' CE1' HD11 ' A' ' 122' ' ' LEU . 21.4 m-85 -92.11 -35.15 14.05 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.19 -0.459 . . . . 51.24 110.958 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.299 0 C-N-CA 120.756 -0.735 . . . . 32.22 112.504 179.919 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.545 ' CH2' HD23 ' A' ' 54' ' ' LEU . 40.5 t-105 . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.763 0.316 . . . . 71.22 110.92 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -67.61 -35.47 79.02 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.274 -0.421 . . . . 72.51 110.93 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 16.9 mm-40 -65.73 -36.72 84.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.108 -0.496 . . . . 61.24 110.905 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.461 ' O ' ' HE3' ' A' ' 62' ' ' MET . . . -57.28 -38.91 74.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.234 -0.439 . . . . 54.34 111.059 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.476 ' CD ' HD13 ' A' ' 35' ' ' LEU . 1.8 tt0 -72.7 -42.98 63.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.212 -0.449 . . . . 73.12 110.867 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.527 ' O ' ' HG3' ' A' ' 20' ' ' LYS . 2.9 m-20 -67.06 -31.49 72.04 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.258 -0.428 . . . . 72.4 110.86 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.478 ' HA ' ' HG2' ' A' ' 21' ' ' ARG . 3.2 m-85 -72.07 -43.07 65.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.153 -0.476 . . . . 75.11 110.914 -179.809 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.48 HD13 ' C ' ' A' ' 19' ' ' LEU . 3.1 tm? -73.61 -33.78 64.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.471 . . . . 72.51 110.879 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.527 ' HG3' ' O ' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -73.06 -35.84 66.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.183 -0.462 . . . . 74.41 110.927 179.769 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.478 ' HG2' ' HA ' ' A' ' 18' ' ' TYR . 0.6 OUTLIER -71.5 -27.96 63.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.208 -0.451 . . . . 74.05 110.869 -179.956 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -60.08 -25.28 65.28 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.193 -0.458 . . . . 74.31 110.833 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 116.203 -0.453 . . . . 72.55 110.899 -179.854 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.476 HD13 ' CD ' ' A' ' 16' ' ' GLN . 5.1 tp . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.797 0.332 . . . . 72.52 110.96 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.3 -51.38 63.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.197 -0.456 . . . . 73.13 110.899 179.865 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.34 -38.91 92.99 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.2 -0.454 . . . . 63.32 111.186 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.451 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 2.3 mmtt -69.34 -42.11 75.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.226 -0.443 . . . . 72.32 110.836 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.565 HD21 HD22 ' A' ' 54' ' ' LEU . 1.7 mp -54.48 -38.71 66.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.317 -0.401 . . . . 72.11 110.922 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -58.69 -45.42 89.51 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.171 -0.468 . . . . 62.43 110.905 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.451 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 1.5 pt-20 -60.67 -32.85 72.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.27 -0.423 . . . . 75.11 110.89 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 9.0 ttt -68.52 -34.1 75.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.113 -0.494 . . . . 63.43 110.884 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.654 ' CD ' HD11 ' A' ' 48' ' ' LEU . 2.5 mm100 -59.95 -39.42 85.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.209 -0.45 . . . . 74.45 110.935 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.9 mmpt? -71.57 -30.6 66.04 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.163 -0.472 . . . . 71.43 110.895 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -70.46 -43.5 69.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.225 -0.443 . . . . 73.32 110.875 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.843 ' CZ ' HD13 ' A' ' 61' ' ' ILE . 6.6 m-85 -82.01 -34.95 29.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.127 -0.488 . . . . 70.43 110.852 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.404 ' HA2' ' HB3' ' A' ' 206' ' ' SER . . . 103.07 -6.97 51.78 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.733 -0.746 . . . . 64.34 112.455 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.654 HD11 ' CD ' ' A' ' 43' ' ' GLN . 0.6 OUTLIER -59.85 137.28 90.4 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-O 121.657 0.741 . . . . 64.11 110.911 -179.893 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.69 -52.23 0.34 Allowed 'Trans proline' 0 C--N 1.343 0.239 0 C-N-CA 122.675 2.25 . . . . 74.5 112.32 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.599 HD12 HG23 ' A' ' 58' ' ' VAL . 0.9 OUTLIER -50.96 108.29 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.206 -0.452 . . . . 71.22 111.186 179.95 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.419 ' HA ' ' HG3' ' A' ' 43' ' ' GLN . 3.6 p -99.21 152.48 19.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.18 -0.464 . . . . 73.25 111.197 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 59.2 17.73 39.23 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.761 -0.733 . . . . 64.24 112.472 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 15.2 mmt -102.8 161.04 14.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.828 0.347 . . . . 75.23 110.848 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.565 HD22 HD21 ' A' ' 39' ' ' LEU . 29.5 tp -168.54 81.94 0.16 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.186 -0.461 . . . . 73.4 110.854 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.405 ' HA ' HG13 ' A' ' 59' ' ' ILE . 1.8 p30 174.5 -28.09 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.227 -0.442 . . . . 44.35 110.936 179.877 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.8 p -87.85 -99.86 0.08 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.121 -0.49 . . . . 75.25 110.843 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.664 ' O ' HG23 ' A' ' 61' ' ' ILE . 17.4 tpt180 -84.97 -29.16 25.3 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.108 -0.496 . . . . 61.22 110.904 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.599 HG23 HD12 ' A' ' 50' ' ' ILE . 84.7 t -60.95 -45.04 99.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.225 -0.443 . . . . 70.12 111.126 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.432 HD13 ' HA ' ' A' ' 59' ' ' ILE . 7.6 mm -75.37 -31.66 24.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.202 -0.454 . . . . 74.43 111.111 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.6 -44.1 93.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.196 -0.457 . . . . 73.45 110.886 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.843 HD13 ' CZ ' ' A' ' 46' ' ' PHE . 1.5 pp -66.82 -29.47 46.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.165 -0.47 . . . . 74.52 111.184 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' MET . . . . . 0.461 ' HE3' ' O ' ' A' ' 15' ' ' ALA . 8.2 mmt -63.0 -38.67 92.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.161 -0.472 . . . . 74.01 110.844 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -84.49 -25.71 28.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.254 -0.43 . . . . 42.22 110.934 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.42 136.24 37.79 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.547 0.689 . . . . 65.34 110.924 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -69.82 156.84 62.16 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.731 2.287 . . . . 72.11 112.28 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.464 ' HG3' ' HA ' ' A' ' 214' ' ' PRO . 13.1 ttp180 -149.88 -83.89 0.1 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.181 -0.463 . . . . 71.51 110.89 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -145.58 153.9 41.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.181 -0.463 . . . . 55.3 110.893 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.554 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -108.02 24.58 22.83 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.745 -0.74 . . . . 64.23 112.457 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.625 HG21 ' CD2' ' A' ' 198' ' ' HIS . 0.2 OUTLIER -106.69 134.38 19.85 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 121.629 0.728 . . . . 74.23 111.065 -179.947 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 70' ' ' PRO . . . . . 0.48 ' HD2' HG12 ' A' ' 69' ' ' VAL . 53.9 Cg_endo -69.75 143.32 50.53 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.717 2.278 . . . . 63.44 112.289 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -102.08 24.52 9.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.233 -0.44 . . . . 74.45 110.878 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 3.9 m . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.221 -0.445 . . . . 53.43 111.13 -179.968 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 C--O 1.231 0.142 0 CA-C-O 120.901 0.292 . . . . 71.11 112.367 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.679 ' HD2' HD22 ' A' ' 237' ' ' LEU . 4.4 mttp -78.82 165.85 23.09 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.217 -0.447 . . . . 64.45 110.91 179.873 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' TRP . . . . . 0.414 ' CD1' ' HA ' ' A' ' 200' ' ' LEU . 52.6 m95 -49.71 137.72 15.49 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.235 -0.439 . . . . 73.31 110.864 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 2.2 t -115.28 -27.14 7.35 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.207 -0.451 . . . . 65.3 111.112 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -53.19 171.41 0.07 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.215 -0.448 . . . . 70.34 110.808 -179.776 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.58 -30.69 20.33 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.133 -0.485 . . . . 71.12 110.905 179.916 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -148.39 140.43 18.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.214 -0.448 . . . . 74.14 111.108 179.888 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 90.4 t -123.35 141.39 43.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.155 -0.475 . . . . 72.25 111.106 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.758 HG22 ' HB3' ' A' ' 125' ' ' ARG . 15.2 p -115.61 155.16 28.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.188 -0.46 . . . . 71.01 111.202 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.437 ' O ' HG21 ' A' ' 127' ' ' VAL . 3.9 p90 -137.42 146.61 44.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.265 -0.425 . . . . 70.51 110.911 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.53 ' HB3' ' HB3' ' A' ' 132' ' ' ALA . 7.7 ttt-85 -150.87 139.09 20.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.123 -0.49 . . . . 71.25 110.9 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.543 HD11 ' HA ' ' A' ' 106' ' ' ASP . 10.3 mm -75.2 133.97 30.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.197 -0.456 . . . . 72.4 111.099 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.679 HG22 ' SD ' ' A' ' 135' ' ' MET . 8.1 t -91.32 -40.63 12.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.162 -0.472 . . . . 60.2 111.114 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -149.05 169.39 20.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.168 -0.469 . . . . 64.24 110.841 -179.818 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 14.8 p90 -132.29 155.01 49.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.161 -0.472 . . . . 72.25 110.925 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.5 t -102.38 141.78 34.66 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.169 -0.469 . . . . 64.11 111.101 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -52.5 -18.7 1.81 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.449 . . . . 72.14 110.863 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -65.08 -37.07 86.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.21 -0.45 . . . . 74.13 110.9 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.5 mp -142.47 152.11 59.46 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.65 0.738 . . . . 72.52 110.899 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' PRO . . . . . 0.572 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.9 Cg_endo -69.7 150.94 69.26 Favored 'Trans proline' 0 C--N 1.343 0.244 0 C-N-CA 122.637 2.225 . . . . 73.11 112.362 179.879 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -52.19 -27.84 16.1 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.19 -0.459 . . . . 74.11 110.828 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.572 HG22 ' HB2' ' A' ' 101' ' ' PRO . 2.2 tp -75.22 -38.91 42.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.212 -0.449 . . . . 74.02 111.173 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 104' ' ' THR . . . . . 0.775 ' O ' HD22 ' A' ' 108' ' ' LEU . 2.9 m -69.34 -36.84 77.32 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.144 -0.48 . . . . 52.11 111.183 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.762 ' O ' HG13 ' A' ' 109' ' ' VAL . 55.2 t -71.43 -43.44 72.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.159 -0.473 . . . . 71.51 111.105 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.616 ' O ' HG22 ' A' ' 109' ' ' VAL . 24.9 t0 -66.54 -37.57 85.29 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.123 -0.489 . . . . 63.44 110.881 179.878 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 107' ' ' ARG . . . . . 0.488 ' HG3' ' N ' ' A' ' 108' ' ' LEU . 0.0 OUTLIER -70.36 -33.38 71.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.248 -0.433 . . . . 75.02 110.829 -179.865 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.775 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -66.11 -48.97 69.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.229 -0.441 . . . . 71.04 110.849 -179.891 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.762 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.4 m -55.13 -43.27 69.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.228 -0.442 . . . . 72.31 111.108 179.82 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.494 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 48.2 t -70.7 -34.33 71.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.149 -0.478 . . . . 72.14 110.867 -179.814 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.451 ' CG ' HD21 ' A' ' 189' ' ' LEU . 0.3 OUTLIER -62.56 -33.34 74.74 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.136 -0.483 . . . . 74.35 110.948 179.92 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -95.39 -40.49 9.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.254 -0.43 . . . . 74.32 111.108 179.792 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.719 ' CD1' HD12 ' A' ' 196' ' ' LEU . 0.4 OUTLIER -65.54 -32.76 74.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.197 -0.456 . . . . 72.0 110.939 -179.999 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 42.4 t30 -65.48 -35.29 80.46 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.187 -0.46 . . . . 72.34 110.84 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' MET . . . . . 0.651 ' O ' HD11 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -68.31 -34.52 76.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.188 -0.46 . . . . 54.12 110.813 179.992 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 116' ' ' TRP . . . . . 0.412 ' CG ' HD11 ' A' ' 200' ' ' LEU . 6.0 m95 -66.99 -44.86 79.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.287 -0.415 . . . . 75.23 111.006 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -73.39 -40.74 47.56 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.73 -0.748 . . . . 73.32 112.45 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.431 ' HG2' ' O ' ' A' ' 115' ' ' MET . 3.8 ptpt -60.75 -18.43 54.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.811 0.338 . . . . 72.42 110.92 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.775 ' HG2' HD13 ' A' ' 226' ' ' LEU . 0.1 OUTLIER -96.87 13.46 28.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.167 -0.47 . . . . 75.24 110.884 179.934 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 0.917 HD12 HD12 ' A' ' 122' ' ' LEU . 3.6 pt -147.92 156.0 44.15 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.591 0.71 . . . . 71.34 111.15 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.77 0.27 5.9 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.675 2.25 . . . . 72.21 112.334 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.917 HD12 HD12 ' A' ' 120' ' ' ILE . 12.5 mt -61.18 -157.92 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.229 -0.441 . . . . 73.22 110.909 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 123' ' ' HIS . . . . . 0.473 ' H ' ' HB3' ' A' ' 122' ' ' LEU . 28.1 t-80 -162.66 137.92 6.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.159 -0.473 . . . . 74.12 110.907 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 17.5 m-30 -122.27 142.35 50.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.199 -0.455 . . . . 75.54 110.889 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.758 ' HB3' HG22 ' A' ' 90' ' ' THR . 0.0 OUTLIER -115.26 140.96 48.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.125 -0.489 . . . . 75.14 110.897 -179.888 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.19 141.62 34.02 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.196 -0.456 . . . . 72.22 110.886 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 127' ' ' VAL . . . . . 0.874 HG11 ' HB2' ' A' ' 132' ' ' ALA . 34.4 m -103.0 139.49 23.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.259 -0.428 . . . . 50.13 111.183 179.8 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -155.13 -29.25 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.165 -0.47 . . . . 74.43 111.077 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -133.22 109.19 9.25 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.146 -0.479 . . . . 71.25 110.881 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.46 -160.69 13.94 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.764 -0.732 . . . . 62.11 112.559 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -101.99 155.77 17.96 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.783 0.325 . . . . 63.25 111.16 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 132' ' ' ALA . . . . . 0.874 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -112.14 165.41 12.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.193 -0.458 . . . . 51.34 111.068 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -69.5 -54.67 13.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.204 -0.453 . . . . 75.41 110.931 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 27.8 mt -83.8 132.57 31.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.138 -0.483 . . . . 70.51 111.111 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 135' ' ' MET . . . . . 0.679 ' SD ' HG22 ' A' ' 94' ' ' VAL . 28.3 mmt -108.81 116.93 32.93 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.158 -0.474 . . . . 72.43 110.932 179.829 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -106.13 88.39 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.251 -0.432 . . . . 70.04 111.124 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 137' ' ' GLY . . . . . 0.454 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -130.17 169.48 21.11 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.701 -0.762 . . . . 63.34 112.47 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 138' ' ' PHE . . . . . 0.491 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 36.5 m-85 -112.78 145.88 39.8 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.875 0.369 . . . . 74.01 110.874 -179.859 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.491 ' HB2' ' O ' ' A' ' 138' ' ' PHE . . . 173.72 166.44 0.18 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.156 -0.475 . . . . 71.21 111.135 179.899 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -104.8 172.96 6.51 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.259 -0.428 . . . . 62.21 110.847 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -54.02 -21.53 17.7 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.69 -0.766 . . . . 74.24 112.476 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -67.08 -12.07 58.9 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.812 0.339 . . . . 75.03 111.092 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 2.0 p80 -68.92 -11.6 60.79 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.252 -0.431 . . . . 71.11 110.855 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 117.68 36.57 0.97 Allowed Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.723 -0.751 . . . . 45.51 112.5 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -120.91 139.97 52.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.76 0.315 . . . . 72.14 110.937 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.23 161.76 18.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.451 . . . . 51.25 110.842 -179.7 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 11.9 m-85 64.71 133.52 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.649 0.738 . . . . 73.4 110.91 -179.864 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.79 134.81 28.82 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.621 2.214 . . . . 74.53 112.336 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -73.59 -33.1 64.45 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.207 -0.451 . . . . 63.52 110.851 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 74.57 -2.5 2.8 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.186 -0.461 . . . . 63.11 110.9 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 49.5 -108.72 0.49 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.706 -0.759 . . . . 71.41 112.531 -179.855 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.87 139.02 38.83 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.627 2.218 . . . . 75.11 112.325 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 103.21 -153.28 18.09 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.752 -0.737 . . . . 70.32 112.425 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -41.87 155.1 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.898 0.38 . . . . 73.25 110.894 -179.867 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 155' ' ' THR . . . . . 0.472 HG23 ' HA2' ' A' ' 68' ' ' GLY . 0.2 OUTLIER 75.31 108.78 0.07 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.132 -0.485 . . . . 44.41 111.158 -179.971 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 156' ' ' LEU . . . . . 1.053 HD21 HG21 ' A' ' 186' ' ' ILE . 0.5 OUTLIER -90.53 -53.67 4.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.177 -0.465 . . . . 75.02 110.866 -179.98 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 157' ' ' ALA . . . . . 0.587 ' HB1' ' O ' ' A' ' 171' ' ' HIS . . . -165.42 148.37 7.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.185 -0.461 . . . . 71.42 111.149 179.823 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 24.0 p-80 -106.13 126.53 52.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.245 -0.434 . . . . 72.02 110.84 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -110.91 160.9 16.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.155 -0.475 . . . . 74.42 111.061 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 13.6 m-85 -111.68 156.96 21.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.215 -0.448 . . . . 75.31 110.913 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 161' ' ' ALA . . . . . 0.69 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -87.79 164.09 35.62 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 121.586 0.708 . . . . 61.04 111.155 179.878 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 162' ' ' PRO . . . . . 0.69 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 54.5 Cg_endo -69.71 81.8 0.78 Allowed 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.755 2.304 . . . . 74.44 112.37 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -146.7 128.8 3.11 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.727 -0.749 . . . . 61.41 112.448 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 63.9 -172.36 0.17 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.8 0.333 . . . . 73.1 111.174 -179.864 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -87.41 -41.51 6.49 Favored Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.736 -0.745 . . . . 74.03 112.409 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 166' ' ' LEU . . . . . 0.554 HD23 ' O ' ' A' ' 166' ' ' LEU . 8.8 tt -71.4 -32.78 68.82 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.84 0.352 . . . . 65.12 110.85 -179.811 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -79.35 172.45 55.11 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.665 -0.778 . . . . 43.43 112.467 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 78.03 23.08 67.13 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.679 -0.772 . . . . 74.31 112.479 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 95.2 m-20 -97.23 167.49 11.0 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.892 0.377 . . . . 63.41 110.837 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.91 130.34 56.15 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.151 -0.477 . . . . 74.21 111.096 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 171' ' ' HIS . . . . . 0.587 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 16.2 m170 -127.24 132.91 50.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.221 -0.445 . . . . 72.53 110.791 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 41.9 m-85 -116.86 139.59 50.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.171 -0.468 . . . . 71.44 110.904 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 65.4 t0 -69.38 97.18 0.95 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.151 -0.477 . . . . 74.11 110.861 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.97 -16.66 7.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.166 -0.47 . . . . 72.25 110.85 -179.858 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -79.48 -19.66 49.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.14 -0.482 . . . . 73.32 110.811 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -78.81 -174.87 4.17 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.237 -0.438 . . . . 63.2 110.932 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 177' ' ' ARG . . . . . 0.455 ' HG3' ' HA3' ' A' ' 185' ' ' GLY . 1.4 ptm180 -116.54 116.74 28.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.222 -0.444 . . . . 63.14 110.831 -179.874 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 178' ' ' TRP . . . . . 0.4 ' CE3' ' HB ' ' A' ' 186' ' ' ILE . 21.4 m95 -117.11 148.14 41.8 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.142 -0.481 . . . . 72.31 110.856 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 179' ' ' THR . . . . . 0.497 HG21 ' OG ' ' A' ' 182' ' ' SER . 7.5 t 179.16 163.65 0.87 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.206 -0.452 . . . . 74.13 111.167 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -128.35 -68.26 0.77 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.171 -0.468 . . . . 45.33 110.87 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -60.34 -15.16 37.14 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.672 -0.775 . . . . 62.41 112.536 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 182' ' ' SER . . . . . 0.497 ' OG ' HG21 ' A' ' 179' ' ' THR . 0.3 OUTLIER -97.51 -24.33 15.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.865 0.364 . . . . 64.5 110.862 -179.773 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 66.7 m 37.84 56.42 1.56 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.158 -0.474 . . . . 64.12 110.821 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 1.3 tp -116.9 -33.2 4.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.102 -0.499 . . . . 74.2 110.867 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 185' ' ' GLY . . . . . 0.455 ' HA3' ' HG3' ' A' ' 177' ' ' ARG . . . -114.37 -142.25 7.93 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.756 -0.735 . . . . 73.01 112.52 179.912 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 186' ' ' ILE . . . . . 1.053 HG21 HD21 ' A' ' 156' ' ' LEU . 11.1 mm -79.07 97.71 2.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.81 0.338 . . . . 73.22 111.125 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -45.53 117.21 1.36 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.199 -0.455 . . . . 71.31 110.815 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 188' ' ' PHE . . . . . 0.684 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.7 t80 -54.09 -36.91 63.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.106 -0.497 . . . . 75.45 110.868 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 189' ' ' LEU . . . . . 0.451 HD21 ' CG ' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -67.21 -47.33 71.2 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.135 -0.484 . . . . 52.02 110.886 -179.94 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -68.93 -41.43 78.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.177 -0.465 . . . . 74.22 110.953 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 191' ' ' ALA . . . . . 0.61 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -69.11 -35.19 76.16 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.138 -0.483 . . . . 50.03 111.062 179.873 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 192' ' ' ALA . . . . . 0.687 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -57.26 -44.05 83.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.225 -0.443 . . . . 52.11 111.034 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.08 -43.49 87.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.226 -0.443 . . . . 72.43 111.169 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 17.6 t-160 -73.12 -42.06 63.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.206 -0.452 . . . . 71.44 110.82 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -70.12 -47.53 61.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.206 -0.452 . . . . 71.01 111.114 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 196' ' ' LEU . . . . . 0.719 HD12 ' CD1' ' A' ' 113' ' ' LEU . 4.5 mm? -64.54 -37.94 89.3 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.192 -0.458 . . . . 74.51 110.901 -179.947 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -60.97 -27.29 66.82 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.757 -0.735 . . . . 52.23 112.501 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 198' ' ' HIS . . . . . 0.625 ' CD2' HG21 ' A' ' 69' ' ' VAL . 6.5 m-70 -67.98 -35.69 78.76 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.732 0.301 . . . . 75.21 110.799 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.96 -20.88 65.1 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.282 -0.417 . . . . 71.13 110.837 -179.764 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 200' ' ' LEU . . . . . 0.473 ' HB2' ' HG2' ' A' ' 202' ' ' MET . 0.5 OUTLIER -88.02 -0.04 56.53 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.175 -0.466 . . . . 64.13 110.926 -179.992 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 83.97 5.53 87.65 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.723 -0.751 . . . . 50.41 112.533 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 202' ' ' MET . . . . . 0.602 ' SD ' HD12 ' A' ' 234' ' ' ILE . 97.7 mmm -62.73 173.11 1.39 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.781 0.324 . . . . 63.21 110.907 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -137.16 169.19 24.08 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.779 -0.724 . . . . 64.44 112.535 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 20.5 m-70 -66.84 151.49 47.41 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.768 0.318 . . . . 74.32 110.857 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -118.99 146.06 45.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.222 -0.445 . . . . 53.34 110.835 -179.771 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 206' ' ' SER . . . . . 0.404 ' HB3' ' HA2' ' A' ' 47' ' ' GLY . 3.6 m -87.86 -4.19 58.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.104 -0.498 . . . . 72.22 110.899 -179.847 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 207' ' ' ASP . . . . . 0.419 ' O ' ' CD1' ' A' ' 213' ' ' TYR . 0.1 OUTLIER -71.33 142.87 87.36 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.571 0.701 . . . . 65.11 110.874 179.916 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.68 -29.96 23.43 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.658 2.238 . . . . 74.53 112.405 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 3.1 p-10 -105.57 25.36 10.85 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.214 -0.448 . . . . 63.52 110.845 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 210' ' ' ALA . . . . . 0.47 ' O ' ' HB2' ' A' ' 213' ' ' TYR . . . -87.31 146.3 25.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.22 -0.445 . . . . 62.23 111.096 179.814 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 211' ' ' VAL . . . . . 0.478 HG12 ' HG3' ' A' ' 212' ' ' MET . 0.4 OUTLIER -73.59 -26.61 22.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.187 -0.46 . . . . 62.04 111.145 179.974 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 212' ' ' MET . . . . . 0.478 ' HG3' HG12 ' A' ' 211' ' ' VAL . 0.0 OUTLIER -87.86 9.87 20.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.12 -0.491 . . . . 75.22 110.87 179.932 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 213' ' ' TYR . . . . . 0.47 ' HB2' ' O ' ' A' ' 210' ' ' ALA . 0.4 OUTLIER -54.93 120.16 27.01 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.676 0.751 . . . . 73.43 110.88 -179.851 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 214' ' ' PRO . . . . . 0.464 ' HA ' ' HG3' ' A' ' 66' ' ' ARG . 53.4 Cg_endo -69.75 -17.97 37.33 Favored 'Trans proline' 0 C--N 1.342 0.184 0 C-N-CA 122.604 2.203 . . . . 63.01 112.374 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -84.26 -2.4 56.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.18 -0.464 . . . . 74.24 111.2 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 1.5 t80 . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.173 -0.467 . . . . 74.14 110.954 -179.88 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.15 0 CA-C-O 120.87 0.367 . . . . 65.01 110.915 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -143.8 160.55 40.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.455 . . . . 64.24 110.937 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 226' ' ' LEU . . . . . 0.775 HD13 ' HG2' ' A' ' 119' ' ' GLU . 6.6 mt -63.81 149.53 46.71 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.227 -0.442 . . . . 53.44 110.885 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 227' ' ' SER . . . . . . . . . . . . . 1.3 t -86.68 152.01 22.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.208 -0.451 . . . . 74.21 110.895 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 10.7 tt0 -64.4 -66.02 0.6 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.164 -0.471 . . . . 74.54 110.927 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 229' ' ' ASP . . . . . 0.439 ' O ' ' HG3' ' A' ' 232' ' ' LYS . 0.2 OUTLIER -56.08 -25.58 45.91 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.185 -0.462 . . . . 72.22 110.844 179.979 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 230' ' ' ASP . . . . . 0.401 ' OD2' HG12 ' A' ' 211' ' ' VAL . 0.5 OUTLIER -69.69 -48.7 58.74 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.205 -0.452 . . . . 74.23 110.855 -179.969 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 231' ' ' ILE . . . . . 0.67 HD11 ' HB3' ' A' ' 226' ' ' LEU . 9.2 mt -68.83 -41.58 82.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.152 -0.476 . . . . 73.41 111.12 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 232' ' ' LYS . . . . . 0.439 ' HG3' ' O ' ' A' ' 229' ' ' ASP . 0.0 OUTLIER -56.67 -32.06 65.03 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.167 -0.47 . . . . 65.42 110.89 179.855 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 233' ' ' GLY . . . . . 0.408 ' N ' ' HG3' ' A' ' 232' ' ' LYS . . . -64.95 -49.94 60.45 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.731 -0.747 . . . . 63.43 112.464 179.942 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 234' ' ' ILE . . . . . 0.602 HD12 ' SD ' ' A' ' 202' ' ' MET . 7.9 tt -72.84 -30.56 33.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.776 0.322 . . . . 71.54 111.173 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 13.0 mt-30 -69.72 -24.31 63.54 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.13 -0.486 . . . . 70.33 110.908 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 236' ' ' LYS . . . . . 0.449 ' HE2' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -73.81 -26.68 60.74 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.148 -0.478 . . . . 51.21 110.909 179.937 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 237' ' ' LEU . . . . . 0.679 HD22 ' HD2' ' A' ' 83' ' ' LYS . 10.3 tt -97.42 -36.17 10.44 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.223 -0.444 . . . . 75.41 110.931 179.911 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 238' ' ' TYR . . . . . 0.447 ' CE2' HD11 ' A' ' 122' ' ' LEU . 54.2 m-85 -92.12 -5.28 53.01 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.181 -0.463 . . . . 51.24 110.877 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.296 0 C-N-CA 120.778 -0.725 . . . . 32.22 112.435 -179.97 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 30.8 t-105 . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.726 0.298 . . . . 71.22 110.895 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -68.49 -35.2 77.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.292 -0.413 . . . . 72.51 110.911 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -62.92 -36.52 83.65 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.151 -0.477 . . . . 61.24 110.949 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.502 ' CB ' HD11 ' A' ' 59' ' ' ILE . . . -57.01 -42.95 81.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.169 -0.469 . . . . 54.34 111.075 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 43.5 tt0 -70.45 -42.98 70.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.259 -0.428 . . . . 73.12 110.911 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -65.8 -31.53 72.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.141 -0.482 . . . . 72.4 110.88 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -62.26 -36.1 80.99 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.185 -0.461 . . . . 75.11 110.873 -179.789 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.712 HD21 ' HG3' ' A' ' 42' ' ' MET . 4.0 mt -70.43 -21.07 62.86 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.127 -0.488 . . . . 72.51 110.935 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.411 ' HG2' ' N ' ' A' ' 21' ' ' ARG . 4.6 ptmt -74.59 -31.21 61.97 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.216 -0.447 . . . . 74.41 110.909 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.411 ' N ' ' HG2' ' A' ' 20' ' ' LYS . 4.4 ptp180 -86.65 -27.45 23.78 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.227 -0.442 . . . . 74.05 110.89 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.414 ' O ' ' HA ' ' A' ' 70' ' ' PRO . 1.7 m-85 -60.78 -13.06 12.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 74.31 110.835 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.131 -0.486 . . . . 72.55 110.959 -179.899 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.581 ' CD2' HD22 ' A' ' 39' ' ' LEU . 1.3 tt . . . . . 0 N--CA 1.46 0.049 0 CA-C-O 120.755 0.312 . . . . 72.52 110.887 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.72 -48.37 74.9 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.191 -0.458 . . . . 73.13 110.92 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.28 -48.52 76.45 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.128 -0.487 . . . . 63.32 111.136 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.499 ' HE3' HD13 ' A' ' 19' ' ' LEU . 0.5 OUTLIER -67.9 -38.64 83.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.234 -0.439 . . . . 72.32 110.856 179.978 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.599 HD21 ' HB2' ' A' ' 54' ' ' LEU . 1.1 mp -54.58 -36.59 64.56 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.242 -0.435 . . . . 72.11 110.859 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.35 -45.68 87.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.173 -0.467 . . . . 62.43 110.907 179.836 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -69.7 -34.81 74.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.211 -0.45 . . . . 75.11 110.917 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.712 ' HG3' HD21 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -68.51 -47.04 68.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.107 -0.497 . . . . 63.43 110.909 179.912 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.55 ' CG ' HD11 ' A' ' 48' ' ' LEU . 3.2 mt-30 -58.57 -44.24 89.7 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.246 -0.434 . . . . 74.45 110.869 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.5 mmpt? -68.26 -29.99 68.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.175 -0.466 . . . . 71.43 110.904 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 30.0 t80 -69.98 -35.39 74.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.182 -0.463 . . . . 73.32 110.903 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.495 ' CB ' HD23 ' A' ' 48' ' ' LEU . 5.3 m-85 -79.57 -29.77 41.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.162 -0.472 . . . . 70.43 110.825 -179.891 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.45 ' HA2' ' HB2' ' A' ' 206' ' ' SER . . . 104.74 -10.56 49.1 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.694 -0.765 . . . . 64.34 112.536 -179.921 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.55 HD11 ' CG ' ' A' ' 43' ' ' GLN . 0.8 OUTLIER -67.27 139.34 94.8 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.683 0.754 . . . . 64.11 110.865 -179.86 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.71 -52.69 0.31 Allowed 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.705 2.27 . . . . 74.5 112.351 179.823 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.446 ' O ' HD12 ' A' ' 48' ' ' LEU . 0.6 OUTLIER -49.24 108.1 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.212 -0.449 . . . . 71.22 111.133 179.939 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 1.5 t -107.01 163.68 12.77 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.198 -0.456 . . . . 73.25 111.131 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 60.82 17.02 49.06 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.747 -0.74 . . . . 64.24 112.465 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -114.13 161.13 18.16 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.852 0.358 . . . . 75.23 110.899 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.599 ' HB2' HD21 ' A' ' 39' ' ' LEU . 55.5 tp -173.29 85.1 0.05 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.23 -0.441 . . . . 73.4 110.929 -179.928 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 172.44 -27.1 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.241 -0.436 . . . . 44.35 110.917 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 2.5 p -88.8 -97.14 0.09 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.224 -0.444 . . . . 75.25 110.875 -179.859 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.6 tpt180 -85.04 -32.38 22.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.146 -0.479 . . . . 61.22 110.89 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 69.1 t -60.14 -45.47 95.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.225 -0.443 . . . . 70.12 111.166 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.502 HD11 ' CB ' ' A' ' 15' ' ' ALA . 0.8 OUTLIER -69.73 -31.32 48.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.168 -0.469 . . . . 74.43 111.113 179.881 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -59.36 -34.15 72.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.227 -0.442 . . . . 73.45 110.917 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.641 HG21 HG22 ' A' ' 215' ' ' THR . 0.2 OUTLIER -78.52 -30.03 15.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.108 -0.496 . . . . 74.52 111.121 179.977 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 5.2 mtt -63.11 -38.23 90.36 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.117 -0.492 . . . . 74.01 110.908 179.843 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -82.27 -23.14 35.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.147 -0.479 . . . . 42.22 110.927 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 27.5 mttm -85.34 140.77 36.5 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.638 0.732 . . . . 65.34 110.837 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.82 157.69 59.41 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.632 2.221 . . . . 72.11 112.361 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.413 ' HG3' ' HA ' ' A' ' 214' ' ' PRO . 34.5 ttp180 -155.18 -82.24 0.07 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.255 -0.429 . . . . 71.51 110.825 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -145.14 156.26 43.78 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.229 -0.441 . . . . 55.3 110.847 -179.862 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.637 ' HA2' HG23 ' A' ' 155' ' ' THR . . . -101.31 17.55 55.43 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.814 -0.708 . . . . 64.23 112.571 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.807 HG12 ' HD2' ' A' ' 70' ' ' PRO . 0.0 OUTLIER -109.19 143.49 27.79 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 121.732 0.777 . . . . 74.23 111.101 -179.95 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 70' ' ' PRO . . . . . 0.807 ' HD2' HG12 ' A' ' 69' ' ' VAL . 53.2 Cg_endo -69.82 163.76 37.1 Favored 'Trans proline' 0 C--N 1.342 0.237 0 C-N-CA 122.713 2.275 . . . . 63.44 112.274 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 54.6 m-20 -112.53 33.79 4.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.152 -0.476 . . . . 74.45 110.822 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 1.8 m . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.224 -0.443 . . . . 53.43 111.229 179.956 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo . . . . . 0 N--CA 1.465 -0.171 0 CA-C-O 120.866 0.277 . . . . 71.11 112.382 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.723 ' CG ' HD22 ' A' ' 237' ' ' LEU . 0.2 OUTLIER -119.8 -168.07 1.54 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.226 -0.443 . . . . 64.45 110.903 179.918 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 58.1 m95 -76.14 140.01 41.56 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.205 -0.452 . . . . 73.31 110.887 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 11.4 t -114.67 -23.64 9.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.224 -0.443 . . . . 65.3 111.147 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -55.05 150.29 10.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.25 -0.432 . . . . 70.34 110.84 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 35.9 mmtt -64.86 -29.81 70.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.105 -0.498 . . . . 71.12 110.898 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -148.63 138.15 15.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 74.14 111.147 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 85.1 t -114.91 130.45 69.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.454 . . . . 72.25 111.118 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.682 HG22 ' HB3' ' A' ' 125' ' ' ARG . 28.6 p -115.91 168.09 10.37 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.155 -0.475 . . . . 71.01 111.125 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 4.2 p90 -146.48 146.78 30.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.163 -0.471 . . . . 70.51 110.888 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 4.4 ttt180 -149.0 138.11 21.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.113 -0.494 . . . . 71.25 110.884 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.409 HD11 ' HA ' ' A' ' 106' ' ' ASP . 10.3 mm -76.48 135.3 27.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.223 -0.444 . . . . 72.4 111.147 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.485 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 17.9 t -91.14 -40.36 12.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.184 -0.462 . . . . 60.2 111.143 179.819 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 25.9 p -142.22 169.49 17.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.127 -0.488 . . . . 64.24 110.855 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 5.2 p90 -115.14 150.74 35.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.124 -0.489 . . . . 72.25 110.889 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.545 ' OG1' HG21 ' A' ' 105' ' ' VAL . 0.2 OUTLIER -83.05 141.05 32.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.083 -0.508 . . . . 64.11 111.139 -179.996 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 3.7 mtt-85 -73.0 -8.28 55.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.215 -0.448 . . . . 72.14 110.908 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -96.53 -26.0 15.43 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.148 -0.478 . . . . 74.13 110.893 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.663 HD21 ' HA ' ' A' ' 179' ' ' THR . 0.8 OUTLIER -135.91 153.51 77.11 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.676 0.75 . . . . 72.52 110.882 -179.904 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 101' ' ' PRO . . . . . 0.608 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.5 Cg_endo -69.76 150.91 68.82 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.684 2.256 . . . . 73.11 112.309 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 6.4 t-160 -53.34 -25.55 15.62 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.102 -0.499 . . . . 74.11 110.852 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.608 HG22 ' HB2' ' A' ' 101' ' ' PRO . 13.2 tt -76.54 -38.37 31.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.239 -0.437 . . . . 74.02 111.13 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 104' ' ' THR . . . . . 0.624 ' O ' HD22 ' A' ' 108' ' ' LEU . 2.9 m -69.14 -40.59 78.15 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.193 -0.458 . . . . 52.11 111.161 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.735 ' O ' HG13 ' A' ' 109' ' ' VAL . 55.9 t -72.92 -46.06 53.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 71.51 111.146 179.869 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.653 ' O ' HG22 ' A' ' 109' ' ' VAL . 60.5 t0 -61.5 -44.9 96.24 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.142 -0.481 . . . . 63.44 110.94 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -70.03 -33.41 71.95 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.161 -0.472 . . . . 75.02 110.87 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.624 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -60.26 -49.27 78.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.451 . . . . 71.04 110.926 -179.94 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.735 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.5 m -55.3 -42.05 64.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.206 -0.452 . . . . 72.31 111.18 179.79 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.469 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 43.2 t -70.22 -33.45 71.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.138 -0.483 . . . . 72.14 110.804 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.458 ' HB3' HD21 ' A' ' 189' ' ' LEU . 0.8 OUTLIER -61.46 -33.05 73.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.15 -0.477 . . . . 74.35 110.853 -179.984 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.75 -40.15 9.11 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.262 -0.426 . . . . 74.32 111.135 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.799 HD12 HD12 ' A' ' 196' ' ' LEU . 0.3 OUTLIER -63.98 -33.63 76.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.216 -0.447 . . . . 72.0 110.891 -179.965 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -65.6 -35.65 81.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.205 -0.452 . . . . 72.34 110.925 179.882 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' MET . . . . . 0.725 ' HB3' HD23 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -66.3 -31.95 73.07 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.13 -0.487 . . . . 54.12 110.913 179.892 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 116' ' ' TRP . . . . . 0.538 ' CZ3' HD11 ' A' ' 226' ' ' LEU . 8.7 m95 -73.98 -45.22 51.45 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.27 -0.423 . . . . 75.23 110.861 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -66.05 -44.75 90.8 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.775 -0.726 . . . . 73.32 112.464 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.471 ' HG3' ' O ' ' A' ' 115' ' ' MET . 0.0 OUTLIER -61.97 -17.38 56.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.702 0.287 . . . . 72.42 110.865 -179.943 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.459 ' HG3' ' HG ' ' A' ' 226' ' ' LEU . 34.5 mm-40 -91.32 2.26 56.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.244 -0.435 . . . . 75.24 110.847 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 1.023 HD12 HD12 ' A' ' 122' ' ' LEU . 6.0 pt -139.29 150.61 64.9 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.659 0.743 . . . . 71.34 111.094 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 6.35 1.34 Allowed 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.699 2.266 . . . . 72.21 112.43 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 1.023 HD12 HD12 ' A' ' 120' ' ' ILE . 11.3 mt -60.96 -161.11 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.129 -0.487 . . . . 73.22 110.986 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 11.6 t-80 -151.03 122.48 7.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.24 -0.436 . . . . 74.12 110.858 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 10.6 m-30 -109.51 148.41 31.25 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.173 -0.467 . . . . 75.54 110.899 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.682 ' HB3' HG22 ' A' ' 90' ' ' THR . 0.0 OUTLIER -133.14 141.9 48.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.117 -0.492 . . . . 75.14 110.848 -179.907 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.8 147.58 30.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.152 -0.476 . . . . 72.22 110.934 -179.977 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 127' ' ' VAL . . . . . 1.02 HG11 ' HB2' ' A' ' 132' ' ' ALA . 30.1 m -103.25 126.29 57.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.26 -0.427 . . . . 50.13 111.162 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.598 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -142.52 -9.89 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.205 -0.452 . . . . 74.43 111.154 179.947 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 129' ' ' TRP . . . . . 0.598 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -155.75 109.08 2.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.116 -0.493 . . . . 71.25 110.87 -179.972 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.15 -159.96 14.38 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.748 -0.739 . . . . 62.11 112.502 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.8 156.21 17.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.842 0.354 . . . . 63.25 111.116 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 132' ' ' ALA . . . . . 1.02 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -111.83 165.1 12.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.191 -0.459 . . . . 51.34 111.081 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -67.66 -55.8 11.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.231 -0.441 . . . . 75.41 110.885 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 31.6 mt -92.4 133.04 35.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.223 -0.444 . . . . 70.51 111.167 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 135' ' ' MET . . . . . 0.485 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 14.7 mmm -111.23 124.48 52.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.226 -0.443 . . . . 72.43 110.875 179.821 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -107.06 91.22 1.7 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.147 -0.479 . . . . 70.04 111.107 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 137' ' ' GLY . . . . . 0.423 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -132.38 164.25 23.9 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.736 -0.745 . . . . 63.34 112.507 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 138' ' ' PHE . . . . . 0.469 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 46.2 m-85 -105.67 144.28 32.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.793 0.33 . . . . 74.01 110.86 -179.819 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.469 ' HB2' ' O ' ' A' ' 138' ' ' PHE . . . 175.15 167.03 0.3 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.143 -0.48 . . . . 71.21 111.033 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 20.8 mtm105 -104.36 173.62 6.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.192 -0.458 . . . . 62.21 110.88 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -56.06 -17.1 15.47 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.734 -0.746 . . . . 74.24 112.547 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -83.5 3.48 32.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.812 0.339 . . . . 75.03 111.118 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 7.2 p80 -69.85 -30.39 67.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.236 -0.438 . . . . 71.11 110.848 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 144.51 41.03 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.747 -0.74 . . . . 45.51 112.462 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 55.4 p-10 -146.64 162.22 38.91 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.839 0.352 . . . . 72.14 110.89 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 51.0 m -81.65 -179.9 7.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.151 -0.477 . . . . 51.25 110.888 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 64.65 123.68 0.02 OUTLIER Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.684 0.754 . . . . 73.4 110.937 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.83 146.19 58.98 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.717 2.278 . . . . 74.53 112.344 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 149' ' ' PHE . . . . . 0.411 ' CE1' ' HB2' ' A' ' 173' ' ' ASP . 0.1 OUTLIER -90.81 -33.19 15.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.21 -0.45 . . . . 63.52 110.882 -179.952 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 73.87 -1.76 2.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.111 -0.495 . . . . 63.11 110.847 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 51.88 -111.83 1.64 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.762 -0.732 . . . . 71.41 112.459 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.82 139.59 40.39 Favored 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.68 2.254 . . . . 75.11 112.333 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 103.14 -153.14 18.12 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.757 -0.735 . . . . 70.32 112.452 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 154' ' ' ASN . . . . . 0.415 ' O ' ' CB ' ' A' ' 155' ' ' THR . 1.4 p-10 -40.81 152.04 0.05 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.913 0.387 . . . . 73.25 110.891 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 155' ' ' THR . . . . . 0.637 HG23 ' HA2' ' A' ' 68' ' ' GLY . 1.4 m 78.34 110.81 0.07 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.189 -0.46 . . . . 44.41 111.112 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 156' ' ' LEU . . . . . 1.053 HD21 HG21 ' A' ' 186' ' ' ILE . 0.7 OUTLIER -92.25 -52.57 4.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.223 -0.444 . . . . 75.02 110.892 179.959 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 157' ' ' ALA . . . . . 0.556 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -166.81 148.12 6.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.246 -0.434 . . . . 71.42 111.087 179.811 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 24.6 p-80 -106.46 125.58 51.17 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.254 -0.43 . . . . 72.02 110.888 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -111.0 154.82 23.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 74.42 111.079 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 18.1 m-85 -104.21 150.09 24.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.183 -0.462 . . . . 75.31 110.842 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 161' ' ' ALA . . . . . 0.652 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -77.67 162.64 67.47 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 121.573 0.701 . . . . 61.04 111.122 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 162' ' ' PRO . . . . . 0.652 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 54.5 Cg_endo -69.68 77.51 1.04 Allowed 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.658 2.239 . . . . 74.44 112.369 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -132.56 124.71 3.94 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.736 -0.745 . . . . 61.41 112.441 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 9.6 p 50.95 -170.72 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.856 0.36 . . . . 73.1 111.172 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -76.1 -57.51 4.0 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.775 -0.726 . . . . 74.03 112.479 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 166' ' ' LEU . . . . . 0.473 HD23 ' O ' ' A' ' 166' ' ' LEU . 7.7 tt -54.37 -39.69 67.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.853 0.358 . . . . 65.12 110.927 -179.886 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -81.01 153.63 34.43 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.693 -0.765 . . . . 43.43 112.446 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 95.12 23.02 21.19 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.747 -0.739 . . . . 74.31 112.537 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 82.4 m-20 -92.14 173.29 7.9 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.825 0.345 . . . . 63.41 110.88 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -118.2 130.63 56.2 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.166 -0.47 . . . . 74.21 111.114 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 171' ' ' HIS . . . . . 0.547 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 16.8 m170 -128.66 132.58 48.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.207 -0.451 . . . . 72.53 110.924 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -116.35 140.16 49.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.253 -0.431 . . . . 71.44 110.902 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 173' ' ' ASP . . . . . 0.411 ' HB2' ' CE1' ' A' ' 149' ' ' PHE . 68.0 t0 -69.22 96.85 0.87 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.117 -0.492 . . . . 74.11 110.778 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 2.6 pp20? -56.42 -17.95 9.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.222 -0.445 . . . . 72.25 110.886 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -79.55 -20.46 47.04 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.117 -0.492 . . . . 73.32 110.944 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 30.0 mm-40 -77.88 -172.4 2.66 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.16 -0.473 . . . . 63.2 110.926 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 177' ' ' ARG . . . . . 0.404 ' HG3' ' HA3' ' A' ' 185' ' ' GLY . 20.2 ptt180 -115.03 115.28 26.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.172 -0.467 . . . . 63.14 110.841 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 53.6 m95 -116.95 142.9 46.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.155 -0.475 . . . . 72.31 110.898 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 179' ' ' THR . . . . . 0.663 ' HA ' HD21 ' A' ' 100' ' ' LEU . 12.2 t -178.16 163.61 1.71 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.252 -0.431 . . . . 74.13 111.156 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -125.28 -68.9 0.82 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.209 -0.45 . . . . 45.33 110.896 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -63.99 -12.99 51.35 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.762 -0.732 . . . . 62.41 112.515 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 182' ' ' SER . . . . . 0.507 ' HB3' HG21 ' A' ' 179' ' ' THR . 0.4 OUTLIER -93.34 -24.41 18.12 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.852 0.358 . . . . 64.5 110.81 -179.712 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 86.9 p 38.27 42.96 0.56 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.185 -0.461 . . . . 64.12 110.839 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 2.3 tt -106.92 -33.42 7.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.126 -0.488 . . . . 74.2 110.913 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 185' ' ' GLY . . . . . 0.404 ' HA3' ' HG3' ' A' ' 177' ' ' ARG . . . -113.11 -145.46 9.38 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.69 -0.767 . . . . 73.01 112.428 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 186' ' ' ILE . . . . . 1.053 HG21 HD21 ' A' ' 156' ' ' LEU . 10.6 mm -78.93 97.77 2.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.875 0.369 . . . . 73.22 111.11 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -44.23 115.21 0.8 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.178 -0.464 . . . . 71.31 110.85 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 188' ' ' PHE . . . . . 0.552 ' HD2' ' HB3' ' A' ' 108' ' ' LEU . 1.4 t80 -53.88 -33.64 57.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.199 -0.455 . . . . 75.45 110.912 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 189' ' ' LEU . . . . . 0.574 HD12 ' HE2' ' A' ' 224' ' ' PHE . 0.2 OUTLIER -67.07 -48.25 68.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.098 -0.501 . . . . 52.02 110.922 -179.997 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.23 -39.77 74.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.151 -0.477 . . . . 74.22 110.938 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 191' ' ' ALA . . . . . 0.553 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -69.87 -34.9 74.18 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.171 -0.468 . . . . 50.03 111.047 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 192' ' ' ALA . . . . . 0.693 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -56.38 -44.61 80.36 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.247 -0.433 . . . . 52.11 111.1 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.77 -43.62 90.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 72.43 111.182 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 15.7 t-160 -72.9 -38.0 67.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.218 -0.446 . . . . 71.44 110.872 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -74.63 -47.38 32.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.201 -0.454 . . . . 71.01 111.117 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 196' ' ' LEU . . . . . 0.799 HD12 HD12 ' A' ' 113' ' ' LEU . 4.6 mm? -63.08 -45.78 90.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.259 -0.428 . . . . 74.51 110.906 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -54.86 -29.47 50.67 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.731 -0.747 . . . . 52.23 112.506 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 198' ' ' HIS . . . . . 0.461 ' CD2' HG21 ' A' ' 69' ' ' VAL . 6.4 m-70 -66.6 -35.89 81.28 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.887 0.375 . . . . 75.21 110.889 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 13.0 t -68.05 -21.28 65.01 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.171 -0.468 . . . . 71.13 110.877 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -89.55 -7.45 54.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.141 -0.481 . . . . 64.13 110.881 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 89.73 9.58 66.12 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.715 -0.755 . . . . 50.41 112.459 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 202' ' ' MET . . . . . . . . . . . . . 18.1 tpp -72.85 135.08 45.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.797 0.332 . . . . 63.21 110.92 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -101.34 159.11 18.71 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.799 -0.715 . . . . 64.44 112.453 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 11.2 m170 -54.77 163.04 1.04 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.736 0.303 . . . . 74.32 110.895 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -124.39 153.93 41.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.255 -0.429 . . . . 53.34 110.912 -179.878 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 206' ' ' SER . . . . . 0.45 ' HB2' ' HA2' ' A' ' 47' ' ' GLY . 7.9 p -88.2 -4.68 58.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.09 -0.504 . . . . 72.22 110.87 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.55 137.51 83.39 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.535 0.683 . . . . 65.11 110.882 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.74 -7.38 20.9 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.628 2.218 . . . . 74.53 112.383 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -125.48 29.32 6.04 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.132 -0.485 . . . . 63.52 110.867 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 210' ' ' ALA . . . . . 0.478 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.24 145.38 26.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.183 -0.462 . . . . 62.23 111.14 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -73.47 -25.14 20.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.218 -0.446 . . . . 62.04 111.143 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 35.3 mmm -95.24 9.52 39.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.451 . . . . 75.22 110.826 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 213' ' ' TYR . . . . . 0.434 ' HB2' ' O ' ' A' ' 210' ' ' ALA . 0.2 OUTLIER -55.59 126.7 64.65 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-O 121.633 0.73 . . . . 73.43 110.926 -179.895 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 214' ' ' PRO . . . . . 0.427 ' HD2' ' CD1' ' A' ' 213' ' ' TYR . 54.1 Cg_endo -69.69 -18.54 37.3 Favored 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.69 2.26 . . . . 63.01 112.313 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 215' ' ' THR . . . . . 0.641 HG22 HG21 ' A' ' 61' ' ' ILE . 18.6 p -99.85 66.97 1.42 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.213 -0.449 . . . . 74.24 111.052 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 116.222 -0.445 . . . . 74.14 110.877 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 224' ' ' PHE . . . . . 0.574 ' HE2' HD12 ' A' ' 189' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.969 0.414 . . . . 65.01 110.855 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.7 -170.8 3.39 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.124 -0.489 . . . . 64.24 110.931 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 226' ' ' LEU . . . . . 0.725 HD23 ' HB3' ' A' ' 115' ' ' MET . 0.9 OUTLIER -59.18 148.93 29.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.258 -0.428 . . . . 53.44 110.922 179.885 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 227' ' ' SER . . . . . 0.478 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 1.9 t -86.73 156.31 20.0 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.14 -0.482 . . . . 74.21 110.889 -179.936 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.71 -63.5 1.24 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.178 -0.464 . . . . 74.54 110.948 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 49.3 t0 -55.66 -27.47 50.16 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.233 -0.44 . . . . 72.22 110.878 179.861 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.77 -48.24 59.98 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.196 -0.456 . . . . 74.23 110.841 -179.977 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 231' ' ' ILE . . . . . 0.528 HD11 ' HB3' ' A' ' 226' ' ' LEU . 12.8 mt -68.32 -43.82 84.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.237 -0.438 . . . . 73.41 111.203 179.924 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.71 -32.45 73.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.074 -0.512 . . . . 65.42 110.867 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -62.78 -49.8 69.59 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.795 -0.717 . . . . 63.43 112.513 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 234' ' ' ILE . . . . . 0.529 ' CD1' HG21 ' A' ' 120' ' ' ILE . 18.9 tt -73.13 -32.27 38.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-O 120.803 0.335 . . . . 71.54 111.161 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -67.15 -29.19 68.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.112 -0.495 . . . . 70.33 110.86 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 236' ' ' LYS . . . . . 0.45 ' HE3' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.49 -24.21 58.98 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.2 -0.455 . . . . 51.21 110.903 179.935 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 237' ' ' LEU . . . . . 0.723 HD22 ' CG ' ' A' ' 83' ' ' LYS . 1.7 tt -97.58 -29.48 13.42 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.241 -0.436 . . . . 75.41 110.949 179.906 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 238' ' ' TYR . . . . . 0.463 ' OH ' HD11 ' A' ' 122' ' ' LEU . 3.9 m-85 -91.91 -35.72 13.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.175 -0.466 . . . . 51.24 110.851 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.255 0 C-N-CA 120.786 -0.721 . . . . 32.22 112.435 -179.971 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.447 ' CE2' HD23 ' A' ' 54' ' ' LEU . 15.8 t-105 . . . . . 0 C--O 1.23 0.077 0 CA-C-O 120.741 0.305 . . . . 71.22 110.926 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -73.17 -36.49 66.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.229 -0.442 . . . . 72.51 110.947 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -63.77 -36.78 85.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.106 -0.497 . . . . 61.24 110.922 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.657 ' HB1' ' HE3' ' A' ' 62' ' ' MET . . . -63.6 -37.33 86.91 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.139 -0.482 . . . . 54.34 111.124 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.672 ' CD ' HD12 ' A' ' 35' ' ' LEU . 0.1 OUTLIER -67.65 -43.02 81.27 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.238 -0.437 . . . . 73.12 110.861 -179.925 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -73.94 -32.42 63.49 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.201 -0.454 . . . . 72.4 110.891 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 3.5 m-30 -70.65 -36.28 73.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.134 -0.485 . . . . 75.11 110.906 -179.795 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.679 HD13 HD22 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -71.7 -21.02 61.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.118 -0.492 . . . . 72.51 110.9 179.919 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 5.2 ptmt -74.77 -32.99 62.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.248 -0.433 . . . . 74.41 110.899 179.868 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.23 -26.4 33.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.244 -0.435 . . . . 74.05 110.852 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -65.3 -7.64 14.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.217 -0.447 . . . . 74.31 110.934 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.43 ' O ' HG23 ' A' ' 72' ' ' VAL . 8.9 m-85 . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.097 -0.501 . . . . 72.55 110.94 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.672 HD12 ' CD ' ' A' ' 16' ' ' GLN . 5.9 tt . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.743 0.306 . . . . 72.52 110.87 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -61.38 -48.78 79.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.242 -0.435 . . . . 73.13 110.893 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.79 -51.2 60.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.148 -0.478 . . . . 63.32 111.079 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.473 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.5 OUTLIER -59.78 -49.68 76.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.239 -0.437 . . . . 72.32 110.867 179.976 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.679 HD22 HD13 ' A' ' 19' ' ' LEU . 0.1 OUTLIER -55.34 -37.51 67.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.267 -0.424 . . . . 72.11 110.952 179.884 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.51 -45.58 88.47 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.219 -0.446 . . . . 62.43 110.844 179.798 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.473 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 2.2 pt-20 -60.56 -32.7 71.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.288 -0.414 . . . . 75.11 110.902 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -68.35 -34.32 75.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.032 -0.531 . . . . 63.43 110.865 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.574 ' OE1' HD11 ' A' ' 48' ' ' LEU . 4.9 mm-40 -58.35 -39.64 80.08 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.275 -0.42 . . . . 74.45 110.895 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.4 mmpt? -66.42 -28.73 68.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.22 -0.445 . . . . 71.43 110.935 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -70.49 -40.92 73.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.19 -0.459 . . . . 73.32 110.932 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.473 ' CB ' HD23 ' A' ' 48' ' ' LEU . 14.8 m-85 -82.03 -35.53 28.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.126 -0.488 . . . . 70.43 110.881 -179.97 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.411 ' HA3' ' HB2' ' A' ' 206' ' ' SER . . . 101.99 -8.99 56.33 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.711 -0.756 . . . . 64.34 112.518 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.574 HD11 ' OE1' ' A' ' 43' ' ' GLN . 0.7 OUTLIER -59.97 139.92 90.52 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.622 0.725 . . . . 64.11 110.922 -179.89 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.511 ' O ' HG23 ' A' ' 51' ' ' THR . 54.0 Cg_endo -69.74 -52.49 0.32 Allowed 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.651 2.234 . . . . 74.5 112.353 179.84 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.543 HD12 HG23 ' A' ' 58' ' ' VAL . 0.8 OUTLIER -52.15 108.06 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.271 -0.422 . . . . 71.22 111.167 179.868 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.511 HG23 ' O ' ' A' ' 49' ' ' PRO . 66.2 p -105.34 156.35 18.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.206 -0.452 . . . . 73.25 111.173 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 58.67 18.21 37.44 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.795 -0.716 . . . . 64.24 112.473 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -113.17 161.1 17.54 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.767 0.318 . . . . 75.23 110.887 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.447 HD23 ' CE2' ' A' ' 12' ' ' TRP . 25.8 tp -164.78 93.98 0.66 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.223 -0.444 . . . . 73.4 110.936 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 178.18 -30.91 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.157 -0.474 . . . . 44.35 110.855 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 29.7 t -89.65 -102.24 0.09 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.175 -0.466 . . . . 75.25 110.919 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 65.9 mtt-85 -84.81 -27.13 27.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.184 -0.462 . . . . 61.22 110.953 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.543 HG23 HD12 ' A' ' 50' ' ' ILE . 84.2 t -65.62 -40.77 88.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.09 -0.504 . . . . 70.12 111.125 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -76.85 -31.43 19.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.214 -0.448 . . . . 74.43 111.145 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -65.02 -44.99 87.33 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.164 -0.471 . . . . 73.45 110.836 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.573 ' CG2' HG23 ' A' ' 215' ' ' THR . 14.9 pt -59.76 -29.63 43.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.163 -0.472 . . . . 74.52 111.148 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' MET . . . . . 0.657 ' HE3' ' HB1' ' A' ' 15' ' ' ALA . 9.7 mmm -60.64 -39.19 87.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.17 -0.468 . . . . 74.01 110.821 179.857 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -93.81 -25.64 17.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.265 -0.425 . . . . 42.22 110.905 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.69 118.35 71.53 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.605 0.717 . . . . 65.34 110.868 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.76 126.29 13.14 Favored 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.683 2.255 . . . . 72.11 112.371 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -121.29 -74.99 0.6 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.169 -0.469 . . . . 71.51 110.862 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 2.8 p -140.72 148.2 40.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.149 -0.478 . . . . 55.3 110.855 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.787 ' CA ' HG23 ' A' ' 155' ' ' THR . . . -93.9 13.88 66.48 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.701 -0.761 . . . . 64.23 112.495 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.632 HG12 ' HD2' ' A' ' 70' ' ' PRO . 0.1 OUTLIER -101.75 137.49 19.57 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.67 0.748 . . . . 74.23 111.073 -179.995 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 70' ' ' PRO . . . . . 0.632 ' HD2' HG12 ' A' ' 69' ' ' VAL . 53.3 Cg_endo -69.83 159.12 54.53 Favored 'Trans proline' 0 C--O 1.231 0.153 0 C-N-CA 122.677 2.251 . . . . 63.44 112.33 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -94.53 4.91 53.24 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.198 -0.456 . . . . 74.45 110.813 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.43 HG23 ' O ' ' A' ' 23' ' ' TYR . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.272 -0.422 . . . . 53.43 111.126 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo . . . . . 0 C--O 1.232 0.189 0 CA-C-O 120.804 0.252 . . . . 71.11 112.316 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.695 ' CE ' HD13 ' A' ' 237' ' ' LEU . 5.1 mttp -74.05 164.98 25.94 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.257 -0.428 . . . . 64.45 110.914 179.92 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' TRP . . . . . 0.499 ' CD1' ' HA ' ' A' ' 200' ' ' LEU . 19.6 m95 -52.86 132.5 37.05 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.248 -0.433 . . . . 73.31 110.87 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 5.6 t -115.08 -15.0 11.77 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.19 -0.459 . . . . 65.3 111.084 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -62.48 165.0 6.65 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.302 -0.408 . . . . 70.34 110.893 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.22 -30.26 38.59 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.165 -0.47 . . . . 71.12 110.909 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 1.1 p -148.12 137.84 16.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.214 -0.448 . . . . 74.14 111.174 179.86 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 97.2 t -119.1 138.66 49.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.158 -0.474 . . . . 72.25 111.141 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.684 HG22 ' HB3' ' A' ' 125' ' ' ARG . 7.5 p -115.87 168.07 10.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.157 -0.474 . . . . 71.01 111.088 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 6.5 p90 -147.08 147.08 30.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.15 -0.477 . . . . 70.51 110.979 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -146.85 136.39 22.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.136 -0.484 . . . . 71.25 110.847 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.639 ' CD1' HG11 ' A' ' 109' ' ' VAL . 16.4 mm -76.05 135.26 27.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.121 -0.49 . . . . 72.4 111.144 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.504 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 21.2 t -88.15 -40.68 13.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.191 -0.459 . . . . 60.2 111.128 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 4.3 t -153.74 158.88 41.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.178 -0.465 . . . . 64.24 110.951 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 10.5 p90 -106.1 147.71 28.64 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.248 -0.433 . . . . 72.25 110.902 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.539 ' O ' ' O ' ' A' ' 100' ' ' LEU . 0.3 OUTLIER -81.71 140.76 34.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.137 -0.483 . . . . 64.11 111.183 179.961 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -62.18 -15.98 49.95 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.244 -0.434 . . . . 72.14 110.834 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -91.16 -25.33 19.62 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.225 -0.443 . . . . 74.13 110.902 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.745 HD21 ' H ' ' A' ' 180' ' ' ASP . 18.4 mt -131.69 140.02 37.02 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.515 0.674 . . . . 72.52 110.928 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' PRO . . . . . 0.604 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.3 Cg_endo -69.8 150.87 68.53 Favored 'Trans proline' 0 C--O 1.232 0.218 0 C-N-CA 122.653 2.235 . . . . 73.11 112.309 179.872 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 3.1 t-160 -49.27 -29.99 6.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.226 -0.443 . . . . 74.11 110.823 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.604 HG22 ' HB2' ' A' ' 101' ' ' PRO . 16.6 tt -72.7 -43.16 61.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.214 -0.448 . . . . 74.02 111.136 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 104' ' ' THR . . . . . 0.599 HG21 HD22 ' A' ' 100' ' ' LEU . 2.3 m -69.63 -38.13 77.06 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.132 -0.485 . . . . 52.11 111.118 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.755 HG13 ' CZ ' ' A' ' 188' ' ' PHE . 75.5 t -72.87 -44.61 57.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.226 -0.443 . . . . 71.51 111.096 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.666 ' O ' HG22 ' A' ' 109' ' ' VAL . 29.7 t70 -62.95 -43.22 99.39 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.216 -0.447 . . . . 63.44 110.87 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -70.13 -33.25 71.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.205 -0.452 . . . . 75.02 110.846 -179.839 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.586 HD23 ' HB3' ' A' ' 188' ' ' PHE . 0.0 OUTLIER -60.18 -47.59 85.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.164 -0.471 . . . . 71.04 110.9 -179.957 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.666 HG22 ' O ' ' A' ' 106' ' ' ASP . 1.4 m -55.2 -41.46 60.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.161 -0.472 . . . . 72.31 111.171 179.843 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.477 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 42.5 t -70.56 -33.64 71.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.169 -0.469 . . . . 72.14 110.858 -179.857 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.589 ' HB3' HD21 ' A' ' 189' ' ' LEU . 0.5 OUTLIER -61.59 -33.1 73.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.099 -0.5 . . . . 74.35 110.879 179.943 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.56 -40.28 9.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.193 -0.458 . . . . 74.32 111.066 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.835 HD12 HD12 ' A' ' 196' ' ' LEU . 0.3 OUTLIER -65.59 -33.62 76.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.181 -0.463 . . . . 72.0 110.913 -179.95 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 44.2 t30 -69.64 -38.23 77.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.181 -0.463 . . . . 72.34 110.899 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' MET . . . . . 0.573 ' HB3' HD23 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -60.42 -34.23 73.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.138 -0.483 . . . . 54.12 110.865 179.897 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 116' ' ' TRP . . . . . 0.452 ' CZ3' HD11 ' A' ' 226' ' ' LEU . 14.5 m95 -70.23 -50.09 43.42 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.243 -0.435 . . . . 75.23 110.928 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 117' ' ' GLY . . . . . 0.433 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -66.34 -36.42 91.63 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.781 -0.724 . . . . 73.32 112.529 179.872 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 43.2 mtmt -61.66 -16.52 49.45 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.706 0.289 . . . . 72.42 110.838 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.704 ' HB3' HG23 ' A' ' 231' ' ' ILE . 71.3 mm-40 -101.32 13.42 35.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.276 -0.42 . . . . 75.24 110.875 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 1.021 HD12 HD12 ' A' ' 122' ' ' LEU . 5.3 pt -148.26 152.18 38.69 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.656 0.741 . . . . 71.34 111.134 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.66 4.7 1.99 Allowed 'Trans proline' 0 C--O 1.232 0.212 0 C-N-CA 122.718 2.279 . . . . 72.21 112.387 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 1.021 HD12 HD12 ' A' ' 120' ' ' ILE . 10.2 mt -60.72 -158.34 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.243 -0.435 . . . . 73.22 110.936 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 123' ' ' HIS . . . . . 0.415 ' H ' ' HB3' ' A' ' 122' ' ' LEU . 29.9 t-80 -161.7 140.69 9.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.144 -0.48 . . . . 74.12 110.809 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 124' ' ' PHE . . . . . 0.411 ' CD2' HD21 ' A' ' 113' ' ' LEU . 37.9 m-85 -125.0 148.41 48.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.192 -0.458 . . . . 75.54 110.875 -179.907 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.684 ' HB3' HG22 ' A' ' 90' ' ' THR . 0.0 OUTLIER -124.38 141.09 52.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.154 -0.476 . . . . 75.14 110.854 -179.896 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.98 139.87 35.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.217 -0.447 . . . . 72.22 110.927 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 127' ' ' VAL . . . . . 0.939 HG11 ' HB2' ' A' ' 132' ' ' ALA . 17.3 m -102.81 131.97 49.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.151 -0.477 . . . . 50.13 111.15 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.451 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -144.41 -23.14 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.219 -0.446 . . . . 74.43 111.132 179.894 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 129' ' ' TRP . . . . . 0.451 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -138.77 109.1 6.47 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.188 -0.46 . . . . 71.25 110.896 -179.997 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 108.18 -159.84 14.12 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.714 -0.755 . . . . 62.11 112.501 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -101.89 155.66 18.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.792 0.33 . . . . 63.25 111.15 -179.877 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 132' ' ' ALA . . . . . 0.939 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -112.22 165.24 12.34 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.181 -0.463 . . . . 51.34 111.088 179.865 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -67.44 -62.8 1.24 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.181 -0.463 . . . . 75.41 110.895 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 134' ' ' ILE . . . . . 0.441 HG23 ' HA ' ' A' ' 169' ' ' ASP . 45.5 mt -87.67 139.8 16.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.227 -0.442 . . . . 70.51 111.163 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 135' ' ' MET . . . . . 0.504 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 16.4 mmm -114.33 130.19 56.66 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.2 -0.455 . . . . 72.43 110.904 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.426 HG21 ' CG1' ' A' ' 109' ' ' VAL . 0.3 OUTLIER -111.17 88.15 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.3 -0.409 . . . . 70.04 111.119 179.969 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 137' ' ' GLY . . . . . 0.415 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -134.11 157.27 22.78 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.673 -0.775 . . . . 63.34 112.389 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 138' ' ' PHE . . . . . 0.579 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 31.2 p90 -105.43 151.62 24.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.886 0.374 . . . . 74.01 110.871 -179.865 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.579 ' HB2' ' O ' ' A' ' 138' ' ' PHE . . . 169.64 168.81 0.05 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.197 -0.456 . . . . 71.21 111.089 179.901 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 18.1 mtp180 -102.64 172.87 6.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.18 -0.463 . . . . 62.21 110.849 -179.852 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -54.03 -17.43 7.43 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.707 -0.759 . . . . 74.24 112.54 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -85.58 13.09 7.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.865 0.364 . . . . 75.03 111.188 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 5.1 p80 -85.91 1.91 48.12 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.21 -0.45 . . . . 71.11 110.864 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 106.07 38.47 2.31 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.764 -0.732 . . . . 45.51 112.465 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -139.71 176.47 8.71 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.844 0.354 . . . . 72.14 110.882 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 66.9 m -85.7 166.76 15.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.222 -0.445 . . . . 51.25 110.844 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 66.23 127.73 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.69 0.757 . . . . 73.4 110.89 -179.905 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.74 152.41 69.41 Favored 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.709 2.273 . . . . 74.53 112.408 179.882 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 149' ' ' PHE . . . . . 0.43 ' C ' ' H ' ' A' ' 151' ' ' GLY . 1.5 p90 -52.65 -25.58 11.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.26 -0.427 . . . . 63.52 110.887 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 75.97 -20.87 0.33 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.179 -0.464 . . . . 63.11 110.875 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 151' ' ' GLY . . . . . 0.43 ' H ' ' C ' ' A' ' 149' ' ' PHE . . . 81.44 -161.29 42.69 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.73 -0.748 . . . . 71.41 112.417 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.68 141.88 46.76 Favored 'Trans proline' 0 C--N 1.343 0.243 0 C-N-CA 122.683 2.255 . . . . 75.11 112.403 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 103.71 -133.29 11.4 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.746 -0.74 . . . . 70.32 112.497 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -37.34 148.31 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.943 0.401 . . . . 73.25 110.855 -179.847 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 155' ' ' THR . . . . . 0.787 HG23 ' CA ' ' A' ' 68' ' ' GLY . 59.6 m 65.72 115.11 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.142 -0.481 . . . . 44.41 111.108 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 156' ' ' LEU . . . . . 1.032 HD21 HG21 ' A' ' 186' ' ' ILE . 1.0 OUTLIER -103.9 -52.72 2.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.179 -0.464 . . . . 75.02 110.897 179.975 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 157' ' ' ALA . . . . . 0.564 ' HB1' ' O ' ' A' ' 171' ' ' HIS . . . -153.76 148.27 26.16 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.235 -0.438 . . . . 71.42 111.073 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 26.3 p-80 -111.01 117.49 33.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.21 -0.45 . . . . 72.02 110.831 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -109.81 148.3 31.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.221 -0.445 . . . . 74.42 111.071 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 -104.06 169.5 8.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.172 -0.467 . . . . 75.31 110.836 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 161' ' ' ALA . . . . . 0.612 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -104.42 161.47 22.77 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.575 0.703 . . . . 61.04 111.161 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 162' ' ' PRO . . . . . 0.612 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.9 Cg_endo -69.68 88.11 0.53 Allowed 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.724 2.283 . . . . 74.44 112.348 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -146.43 136.78 6.44 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.767 -0.73 . . . . 61.41 112.463 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 2.7 m 72.24 -69.2 0.19 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.82 0.343 . . . . 73.1 111.122 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . 160.44 -59.49 0.31 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.76 -0.733 . . . . 74.03 112.527 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 166' ' ' LEU . . . . . 0.414 ' C ' HD23 ' A' ' 166' ' ' LEU . 10.3 tt -54.07 -35.13 61.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.865 0.364 . . . . 65.12 110.944 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -74.28 -163.75 10.07 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.726 -0.75 . . . . 43.43 112.494 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 73.13 11.9 79.32 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.676 -0.773 . . . . 74.31 112.435 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 169' ' ' ASP . . . . . 0.441 ' HA ' HG23 ' A' ' 134' ' ' ILE . 61.7 m-20 -91.51 171.38 9.23 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.829 0.347 . . . . 63.41 110.855 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -117.5 131.58 56.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.211 -0.45 . . . . 74.21 111.082 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 171' ' ' HIS . . . . . 0.564 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 28.7 m170 -124.72 158.86 32.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.21 -0.45 . . . . 72.53 110.854 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 172' ' ' PHE . . . . . 0.438 ' HB3' ' CZ2' ' A' ' 178' ' ' TRP . 25.0 m-85 -134.03 143.99 48.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.183 -0.462 . . . . 71.44 110.896 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 173' ' ' ASP . . . . . 0.438 ' CB ' ' O ' ' A' ' 156' ' ' LEU . 49.1 t0 -71.07 103.28 2.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.109 -0.496 . . . . 74.11 110.829 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 174' ' ' GLU . . . . . 0.454 ' HB2' ' C ' ' A' ' 139' ' ' ALA . 0.5 OUTLIER -58.27 -16.92 15.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.158 -0.474 . . . . 72.25 110.907 -179.939 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -77.85 -15.16 59.26 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.148 -0.478 . . . . 73.32 110.851 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -89.73 176.78 6.72 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.202 -0.454 . . . . 63.2 110.878 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 77.8 mtt180 -103.02 123.05 45.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.143 -0.481 . . . . 63.14 110.882 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 178' ' ' TRP . . . . . 0.488 ' HB2' HG21 ' A' ' 97' ' ' THR . 44.4 m95 -117.48 132.38 56.56 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.217 -0.447 . . . . 72.31 110.904 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 179' ' ' THR . . . . . 0.597 HG21 ' HB3' ' A' ' 182' ' ' SER . 3.5 t -177.46 164.13 2.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.235 -0.439 . . . . 74.13 111.15 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 180' ' ' ASP . . . . . 0.745 ' H ' HD21 ' A' ' 100' ' ' LEU . 3.9 t70 -124.03 -68.77 0.85 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.211 -0.45 . . . . 45.33 110.818 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -66.15 -10.87 53.8 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.772 -0.728 . . . . 62.41 112.548 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 182' ' ' SER . . . . . 0.597 ' HB3' HG21 ' A' ' 179' ' ' THR . 0.2 OUTLIER -97.65 -24.34 15.56 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.887 0.375 . . . . 64.5 110.854 -179.766 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 183' ' ' SER . . . . . 0.435 ' C ' ' O ' ' A' ' 182' ' ' SER . 1.8 p 34.55 65.43 0.34 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.133 -0.485 . . . . 64.12 110.815 -179.838 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -117.1 -33.76 4.6 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.157 -0.474 . . . . 74.2 110.895 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -124.54 -136.33 4.6 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.797 -0.716 . . . . 73.01 112.508 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 186' ' ' ILE . . . . . 1.032 HG21 HD21 ' A' ' 156' ' ' LEU . 7.3 mm -79.21 105.88 9.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-O 120.872 0.368 . . . . 73.22 111.092 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -51.07 123.9 10.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.138 -0.483 . . . . 71.31 110.838 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 188' ' ' PHE . . . . . 0.755 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 4.3 t80 -53.6 -35.52 60.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.171 -0.468 . . . . 75.45 110.896 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 189' ' ' LEU . . . . . 0.589 HD21 ' HB3' ' A' ' 111' ' ' LYS . 0.1 OUTLIER -67.46 -47.38 70.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.113 -0.494 . . . . 52.02 110.915 -179.892 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -66.06 -37.55 86.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.159 -0.473 . . . . 74.22 110.948 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -72.54 -35.34 68.02 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.109 -0.496 . . . . 50.03 111.095 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 192' ' ' ALA . . . . . 0.705 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -60.8 -44.62 96.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.235 -0.439 . . . . 52.11 111.04 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -58.1 -44.47 87.69 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.219 -0.446 . . . . 72.43 111.162 -179.884 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 2.8 t60 -72.58 -42.76 64.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.138 -0.483 . . . . 71.44 110.842 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -68.84 -47.23 66.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.233 -0.44 . . . . 71.01 111.114 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 196' ' ' LEU . . . . . 0.835 HD12 HD12 ' A' ' 113' ' ' LEU . 4.5 mm? -63.13 -43.61 97.91 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.239 -0.437 . . . . 74.51 110.912 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -56.2 -29.29 56.02 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.707 -0.758 . . . . 52.23 112.522 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 198' ' ' HIS . . . . . 0.481 ' CD2' HG21 ' A' ' 69' ' ' VAL . 5.9 m-70 -68.03 -40.32 82.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.864 0.364 . . . . 75.21 110.899 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.85 -21.17 62.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.17 -0.468 . . . . 71.13 110.828 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 200' ' ' LEU . . . . . 0.499 ' HA ' ' CD1' ' A' ' 84' ' ' TRP . 0.6 OUTLIER -90.44 2.75 55.35 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.147 -0.479 . . . . 64.13 110.915 179.992 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 83.71 -4.03 83.5 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.729 -0.748 . . . . 50.41 112.483 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 202' ' ' MET . . . . . 0.496 ' SD ' HD12 ' A' ' 234' ' ' ILE . 97.9 mmm -63.85 133.46 53.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.789 0.328 . . . . 63.21 110.877 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -101.48 -176.34 28.6 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.781 -0.724 . . . . 64.44 112.526 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 20.7 m-70 -73.84 144.34 45.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.798 0.332 . . . . 74.32 110.893 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -103.93 153.46 20.77 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.249 -0.432 . . . . 53.34 110.838 -179.776 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 206' ' ' SER . . . . . 0.411 ' HB2' ' HA3' ' A' ' 47' ' ' GLY . 6.5 p -87.79 -4.78 58.86 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.486 . . . . 72.22 110.814 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.55 137.82 83.4 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.619 0.723 . . . . 65.11 110.881 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 -6.62 19.01 Favored 'Trans proline' 0 C--N 1.342 0.222 0 C-N-CA 122.682 2.254 . . . . 74.53 112.336 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -127.92 30.16 5.31 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.189 -0.46 . . . . 63.52 110.886 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 210' ' ' ALA . . . . . 0.48 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.22 145.51 26.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.194 -0.457 . . . . 62.23 111.132 179.851 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 211' ' ' VAL . . . . . 0.409 HG12 ' OD2' ' A' ' 230' ' ' ASP . 0.4 OUTLIER -68.35 -27.52 37.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.238 -0.437 . . . . 62.04 111.145 179.954 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -98.25 10.53 40.41 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.209 -0.451 . . . . 75.22 110.846 179.943 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 213' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -55.71 118.08 18.19 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.698 0.761 . . . . 73.43 110.909 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.82 -18.47 36.71 Favored 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 122.611 2.207 . . . . 63.01 112.363 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 215' ' ' THR . . . . . 0.573 HG23 ' CG2' ' A' ' 61' ' ' ILE . 0.3 OUTLIER -84.79 49.97 1.82 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.174 -0.466 . . . . 74.24 111.172 179.988 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 5.5 t80 . . . . . 0 C--N 1.328 -0.346 0 CA-C-N 116.202 -0.454 . . . . 74.14 110.925 -179.915 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.458 -0.029 0 CA-C-O 120.906 0.384 . . . . 65.01 110.938 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -143.87 -167.9 2.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.087 -0.506 . . . . 64.24 110.919 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 226' ' ' LEU . . . . . 0.684 ' HB3' HD11 ' A' ' 231' ' ' ILE . 0.6 OUTLIER -59.56 149.2 30.73 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.262 -0.426 . . . . 53.44 110.939 179.885 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 227' ' ' SER . . . . . 0.48 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 1.4 t -86.93 154.84 20.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 74.21 110.932 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -62.82 -65.35 0.7 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.214 -0.448 . . . . 74.54 110.897 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -55.59 -26.09 41.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.225 -0.443 . . . . 72.22 110.863 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 230' ' ' ASP . . . . . 0.409 ' OD2' HG12 ' A' ' 211' ' ' VAL . 21.4 m-20 -69.64 -48.25 60.58 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.198 -0.456 . . . . 74.23 110.872 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 231' ' ' ILE . . . . . 0.704 HG23 ' HB3' ' A' ' 119' ' ' GLU . 8.6 mt -68.29 -42.82 84.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.171 -0.468 . . . . 73.41 111.211 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.21 -32.58 74.02 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.104 -0.498 . . . . 65.42 110.888 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -65.8 -48.3 68.01 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.748 -0.739 . . . . 63.43 112.495 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 234' ' ' ILE . . . . . 0.496 HD12 ' SD ' ' A' ' 202' ' ' MET . 11.8 tt -72.82 -30.61 33.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.79 0.328 . . . . 71.54 111.113 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -70.24 -24.03 63.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.147 -0.479 . . . . 70.33 110.907 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 236' ' ' LYS . . . . . 0.418 ' HE2' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.49 -27.29 60.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.199 -0.455 . . . . 51.21 110.908 179.974 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 237' ' ' LEU . . . . . 0.695 HD13 ' CE ' ' A' ' 83' ' ' LYS . 9.8 tt -98.03 -32.55 11.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.167 -0.47 . . . . 75.41 110.911 179.922 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 238' ' ' TYR . . . . . 0.438 ' CE2' HD11 ' A' ' 122' ' ' LEU . 32.4 m-85 -91.87 -35.18 14.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.2 -0.455 . . . . 51.24 110.917 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.33 0 C-N-CA 120.746 -0.74 . . . . 32.22 112.494 179.979 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 5.4 t-105 . . . . . 0 C--O 1.23 0.066 0 CA-C-O 120.699 0.285 . . . . 71.22 110.933 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -73.31 -39.16 65.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.259 -0.428 . . . . 72.51 110.921 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 -74.05 -35.97 64.35 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.135 -0.484 . . . . 61.24 110.93 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.575 ' CB ' HD11 ' A' ' 59' ' ' ILE . . . -56.91 -44.16 82.13 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.225 -0.443 . . . . 54.34 111.123 179.894 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -73.53 -37.41 65.62 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.189 -0.46 . . . . 73.12 110.889 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -67.92 -30.98 70.44 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.174 -0.466 . . . . 72.4 110.93 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -69.95 -35.99 74.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.207 -0.451 . . . . 75.11 110.944 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.485 HD11 ' SD ' ' A' ' 42' ' ' MET . 0.4 OUTLIER -68.78 -20.93 64.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.17 -0.468 . . . . 72.51 110.923 179.985 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.405 ' HG2' ' N ' ' A' ' 21' ' ' ARG . 5.7 ptmt -74.85 -31.48 61.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.168 -0.469 . . . . 74.41 110.903 179.788 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.405 ' N ' ' HG2' ' A' ' 20' ' ' LYS . 2.2 ptp180 -86.37 -27.93 23.94 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.202 -0.454 . . . . 74.05 110.896 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.0 m-30 -77.82 -0.84 28.78 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.256 -0.429 . . . . 74.31 110.856 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.406 ' O ' ' HB2' ' A' ' 70' ' ' PRO . 2.9 m-85 . . . . . 0 C--N 1.329 -0.326 0 CA-C-N 116.112 -0.495 . . . . 72.55 110.946 -179.808 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.618 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 3.6 mm? . . . . . 0 CA--C 1.526 0.041 0 CA-C-O 120.743 0.306 . . . . 72.52 110.901 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.472 ' HA ' HD12 ' A' ' 39' ' ' LEU . 0.9 OUTLIER -56.75 -50.37 72.46 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.165 -0.47 . . . . 73.13 110.88 179.916 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -52.64 -36.56 56.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.161 -0.472 . . . . 63.32 111.111 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.465 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.1 OUTLIER -70.7 -41.61 71.73 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.182 -0.463 . . . . 72.32 110.92 179.931 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.618 ' HG ' ' O ' ' A' ' 35' ' ' LEU . 25.4 mt -54.32 -38.05 65.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.215 -0.448 . . . . 72.11 110.951 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.0 mttt -58.72 -45.57 89.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.16 -0.473 . . . . 62.43 110.929 179.779 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.465 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 2.3 pt-20 -60.93 -32.68 72.17 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.219 -0.446 . . . . 75.11 110.912 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.707 ' HE1' HG13 ' A' ' 58' ' ' VAL . 4.5 ttt -66.83 -34.16 77.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.15 -0.477 . . . . 63.43 110.926 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.756 ' OE1' HD11 ' A' ' 48' ' ' LEU . 2.5 mm-40 -58.67 -40.05 82.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.455 . . . . 74.45 110.89 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.7 mmpt? -72.79 -33.49 66.3 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.233 -0.44 . . . . 71.43 110.875 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 32.7 t80 -71.0 -37.18 72.67 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.26 -0.427 . . . . 73.32 110.848 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.526 ' CB ' HD23 ' A' ' 48' ' ' LEU . 6.8 m-85 -81.78 -35.22 29.8 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.22 -0.446 . . . . 70.43 110.931 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 105.83 -10.34 44.76 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.748 -0.739 . . . . 64.34 112.509 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.756 HD11 ' OE1' ' A' ' 43' ' ' GLN . 0.9 OUTLIER -66.0 135.79 95.35 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.619 0.723 . . . . 64.11 110.898 -179.906 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.76 -52.9 0.3 Allowed 'Trans proline' 0 C--N 1.342 0.228 0 C-N-CA 122.697 2.264 . . . . 74.5 112.325 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.455 ' O ' HD12 ' A' ' 48' ' ' LEU . 0.9 OUTLIER -52.67 108.22 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.205 -0.452 . . . . 71.22 111.13 179.949 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.687 HG22 ' CB ' ' A' ' 43' ' ' GLN . 21.1 p -107.88 168.09 9.52 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.165 -0.47 . . . . 73.25 111.126 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 60.16 16.92 43.49 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.688 -0.768 . . . . 64.24 112.494 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' MET . . . . . 0.568 ' O ' HG21 ' A' ' 58' ' ' VAL . 1.0 OUTLIER -128.12 134.02 49.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.772 0.32 . . . . 75.23 110.844 -179.907 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.43 ' HA ' ' HB ' ' A' ' 58' ' ' VAL . 24.6 tp -145.36 93.1 2.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.193 -0.458 . . . . 73.4 110.892 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.6 p30 174.38 -29.68 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.219 -0.446 . . . . 44.35 110.925 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 24.1 t -83.86 -97.68 0.06 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.151 -0.477 . . . . 75.25 110.833 -179.832 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 8.8 tpt180 -85.09 -33.05 22.5 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.14 -0.482 . . . . 61.22 110.949 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.707 HG13 ' HE1' ' A' ' 42' ' ' MET . 44.7 t -59.06 -49.34 83.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.191 -0.459 . . . . 70.12 111.148 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.575 HD11 ' CB ' ' A' ' 15' ' ' ALA . 0.5 OUTLIER -63.99 -30.9 51.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.162 -0.472 . . . . 74.43 111.082 179.913 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.01 -40.4 84.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.261 -0.427 . . . . 73.45 110.931 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.689 HD13 HG22 ' A' ' 215' ' ' THR . 0.8 OUTLIER -78.26 -30.1 15.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.133 -0.485 . . . . 74.52 111.144 179.937 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 7.9 mmm -68.18 -35.14 77.55 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.181 -0.463 . . . . 74.01 110.893 179.875 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -83.87 -24.33 30.91 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.182 -0.463 . . . . 42.22 110.918 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.25 148.48 50.11 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.54 0.686 . . . . 65.34 110.958 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.8 154.22 67.85 Favored 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.663 2.242 . . . . 72.11 112.344 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 40.9 ttp180 -153.38 -84.02 0.07 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.225 -0.443 . . . . 71.51 110.872 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -145.48 156.19 43.57 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.178 -0.465 . . . . 55.3 110.925 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.527 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -100.12 20.55 48.39 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.701 -0.762 . . . . 64.23 112.488 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.763 HG12 ' HD2' ' A' ' 70' ' ' PRO . 0.0 OUTLIER -111.29 141.88 25.28 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.725 0.774 . . . . 74.23 111.122 179.979 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 70' ' ' PRO . . . . . 0.763 ' HD2' HG12 ' A' ' 69' ' ' VAL . 54.4 Cg_endo -69.71 139.02 39.36 Favored 'Trans proline' 0 C--N 1.342 0.207 0 C-N-CA 122.736 2.291 . . . . 63.44 112.349 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 87.7 m-20 -61.55 -17.01 53.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.191 -0.459 . . . . 74.45 110.89 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.186 -0.461 . . . . 53.43 111.165 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.821 0.259 . . . . 71.11 112.29 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.697 ' HD2' HD22 ' A' ' 237' ' ' LEU . 1.9 mttp -82.33 163.35 21.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.24 -0.436 . . . . 64.45 110.905 179.874 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' TRP . . . . . 0.502 ' CD1' ' HA ' ' A' ' 200' ' ' LEU . 47.0 m95 -62.95 135.2 57.17 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.226 -0.443 . . . . 73.31 110.955 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.35 1.37 13.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.303 -0.408 . . . . 65.3 111.154 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -77.81 163.71 25.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.152 -0.476 . . . . 70.34 110.908 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.72 -6.81 59.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.156 -0.475 . . . . 71.12 110.929 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -170.51 138.83 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.206 -0.452 . . . . 74.14 111.141 179.9 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 95.9 t -123.39 135.62 62.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.234 -0.439 . . . . 72.25 111.088 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.693 HG22 ' HB3' ' A' ' 125' ' ' ARG . 9.5 p -115.07 168.1 10.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.155 -0.475 . . . . 71.01 111.142 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.404 ' N ' ' CD1' ' A' ' 91' ' ' TYR . 2.9 p90 -144.58 147.42 33.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.18 -0.464 . . . . 70.51 110.947 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.408 ' CB ' ' HB3' ' A' ' 132' ' ' ALA . 5.4 tpt85 -148.03 134.72 19.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.138 -0.483 . . . . 71.25 110.871 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.437 HD11 ' HA ' ' A' ' 106' ' ' ASP . 10.2 mm -77.21 135.32 26.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.183 -0.462 . . . . 72.4 111.128 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.473 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 18.3 t -93.98 -40.5 11.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.22 -0.445 . . . . 60.2 111.138 179.857 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -151.63 169.56 21.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.081 -0.509 . . . . 64.24 110.848 -179.865 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 16.1 p90 -130.12 155.24 46.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.141 -0.481 . . . . 72.25 110.971 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.5 t -100.64 142.19 32.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 64.11 111.136 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -52.08 -18.46 1.44 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.215 -0.448 . . . . 72.14 110.859 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.97 -36.7 85.23 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.186 -0.461 . . . . 74.13 110.863 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.435 HD23 HG21 ' A' ' 104' ' ' THR . 1.7 mp -144.07 152.81 55.72 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-O 121.623 0.725 . . . . 72.52 110.934 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' PRO . . . . . 0.57 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.7 Cg_endo -69.83 151.27 68.6 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.662 2.241 . . . . 73.11 112.319 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 2.7 t-160 -50.8 -28.3 9.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.18 -0.464 . . . . 74.11 110.88 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.57 HG22 ' HB2' ' A' ' 101' ' ' PRO . 2.7 tp -75.65 -38.32 37.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.205 -0.452 . . . . 74.02 111.068 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' THR . . . . . 0.771 ' O ' HD22 ' A' ' 108' ' ' LEU . 3.1 m -69.21 -37.88 78.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.168 -0.469 . . . . 52.11 111.125 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.805 ' O ' HG13 ' A' ' 109' ' ' VAL . 65.5 t -71.68 -44.48 69.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.214 -0.448 . . . . 71.51 111.15 179.885 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.648 ' O ' HG22 ' A' ' 109' ' ' VAL . 26.9 t0 -63.96 -38.55 91.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 63.44 110.85 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 107' ' ' ARG . . . . . 0.498 ' HG3' ' N ' ' A' ' 108' ' ' LEU . 0.0 OUTLIER -70.55 -33.44 71.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.189 -0.46 . . . . 75.02 110.875 -179.89 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.771 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -66.21 -48.55 70.25 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.201 -0.454 . . . . 71.04 110.922 -179.993 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.805 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.5 m -55.01 -43.17 68.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.189 -0.459 . . . . 72.31 111.06 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.487 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 45.3 t -70.65 -33.93 71.49 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.194 -0.457 . . . . 72.14 110.869 -179.789 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.48 ' HB3' HD21 ' A' ' 189' ' ' LEU . 0.3 OUTLIER -62.1 -33.17 73.94 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.087 -0.506 . . . . 74.35 110.928 179.927 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.71 -40.27 9.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.244 -0.434 . . . . 74.32 111.135 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.788 HD12 HD12 ' A' ' 196' ' ' LEU . 0.4 OUTLIER -64.32 -33.04 74.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.135 -0.484 . . . . 72.0 110.915 179.981 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 45.0 t30 -69.82 -40.14 76.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.174 -0.466 . . . . 72.34 110.876 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 115' ' ' MET . . . . . 0.441 ' HB3' HD23 ' A' ' 226' ' ' LEU . 0.4 OUTLIER -59.71 -34.33 72.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.163 -0.471 . . . . 54.12 110.921 179.905 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 116' ' ' TRP . . . . . 0.554 ' CZ3' HD11 ' A' ' 226' ' ' LEU . 13.3 m95 -65.8 -52.24 52.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.223 -0.444 . . . . 75.23 110.922 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 117' ' ' GLY . . . . . 0.447 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -63.52 -34.01 88.8 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.694 -0.765 . . . . 73.32 112.497 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.4 mtmt -63.67 -14.44 52.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.752 0.31 . . . . 72.42 110.892 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.425 ' HB3' HG23 ' A' ' 231' ' ' ILE . 61.2 mm-40 -104.04 13.27 32.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.233 -0.44 . . . . 75.24 110.894 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 1.01 HD12 HD12 ' A' ' 122' ' ' LEU . 6.7 pt -147.71 153.13 42.58 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.653 0.74 . . . . 71.34 111.149 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 1.99 3.91 Favored 'Trans proline' 0 C--N 1.342 0.226 0 C-N-CA 122.658 2.239 . . . . 72.21 112.362 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 1.01 HD12 HD12 ' A' ' 120' ' ' ILE . 5.9 mt -61.46 -158.25 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.208 -0.451 . . . . 73.22 110.885 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 123' ' ' HIS . . . . . 0.405 ' H ' ' HB3' ' A' ' 122' ' ' LEU . 42.5 t-80 -160.15 145.05 14.82 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.116 -0.493 . . . . 74.12 110.843 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 124' ' ' PHE . . . . . 0.5 ' CD2' HD21 ' A' ' 113' ' ' LEU . 42.4 m-85 -126.08 148.94 49.23 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.174 -0.466 . . . . 75.54 110.882 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.693 ' HB3' HG22 ' A' ' 90' ' ' THR . 0.0 OUTLIER -128.01 140.96 51.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.16 -0.473 . . . . 75.14 110.857 -179.921 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 126' ' ' LYS . . . . . 0.401 ' HD3' ' N ' ' A' ' 127' ' ' VAL . 0.0 OUTLIER -81.01 141.19 34.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 72.22 110.869 179.988 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 127' ' ' VAL . . . . . 0.952 HG11 ' HB2' ' A' ' 132' ' ' ALA . 22.2 m -102.92 133.79 45.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.214 -0.448 . . . . 50.13 111.177 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.427 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -147.06 -24.83 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.191 -0.459 . . . . 74.43 111.19 179.886 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 129' ' ' TRP . . . . . 0.427 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -136.72 109.15 7.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.117 -0.492 . . . . 71.25 110.885 179.972 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.44 -159.74 14.39 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.756 -0.735 . . . . 62.11 112.482 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -101.8 155.54 18.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.786 0.326 . . . . 63.25 111.168 -179.88 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 132' ' ' ALA . . . . . 0.952 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -112.07 165.38 12.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.2 -0.455 . . . . 51.34 111.083 179.86 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -66.48 -62.8 1.27 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.191 -0.459 . . . . 75.41 110.853 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 134' ' ' ILE . . . . . 0.494 HG23 ' HA ' ' A' ' 169' ' ' ASP . 37.6 mt -86.41 130.48 36.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.211 -0.45 . . . . 70.51 111.143 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 135' ' ' MET . . . . . 0.473 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 13.7 mmm -107.06 124.9 50.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.12 -0.491 . . . . 72.43 110.914 179.877 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -108.52 92.29 2.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.23 -0.441 . . . . 70.04 111.096 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 137' ' ' GLY . . . . . 0.429 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -130.31 170.15 20.99 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.738 -0.744 . . . . 63.34 112.497 179.865 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 138' ' ' PHE . . . . . 0.462 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 48.2 m-85 -108.61 149.62 28.65 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.875 0.369 . . . . 74.01 110.938 -179.906 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.606 ' HB1' ' CB ' ' A' ' 143' ' ' HIS . . . 175.83 166.91 0.39 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.456 . . . . 71.21 111.1 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 22.2 mtm180 -104.26 173.09 6.45 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.214 -0.448 . . . . 62.21 110.908 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -58.09 -15.73 23.04 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.722 -0.751 . . . . 74.24 112.466 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -99.05 13.36 33.09 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.769 0.319 . . . . 75.03 111.165 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 143' ' ' HIS . . . . . 0.606 ' CB ' ' HB1' ' A' ' 139' ' ' ALA . 5.0 p80 -72.26 -8.86 57.13 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.172 -0.467 . . . . 71.11 110.843 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 117.95 50.38 0.35 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.773 -0.727 . . . . 45.51 112.55 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -172.7 171.86 4.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.808 0.337 . . . . 72.14 110.911 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 27.1 p -64.09 -179.79 0.46 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.18 -0.464 . . . . 51.25 110.849 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 147' ' ' TYR . . . . . 0.44 ' HA ' ' HD2' ' A' ' 148' ' ' PRO . 0.3 OUTLIER 64.48 103.92 0.03 OUTLIER Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.727 0.775 . . . . 73.4 110.949 -179.905 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 148' ' ' PRO . . . . . 0.44 ' HD2' ' HA ' ' A' ' 147' ' ' TYR . 54.2 Cg_endo -69.77 151.97 69.17 Favored 'Trans proline' 0 C--N 1.342 0.228 0 C-N-CA 122.612 2.208 . . . . 74.53 112.372 179.935 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 149' ' ' PHE . . . . . 0.404 ' O ' ' CG ' ' A' ' 150' ' ' ASP . 0.3 OUTLIER -53.38 -24.26 11.83 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.166 -0.47 . . . . 63.52 110.842 -179.942 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 150' ' ' ASP . . . . . 0.404 ' CG ' ' O ' ' A' ' 149' ' ' PHE . 1.9 p30 44.93 25.43 0.15 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.191 -0.459 . . . . 63.11 110.861 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 44.69 -165.05 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.719 -0.753 . . . . 71.41 112.48 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.72 144.36 53.98 Favored 'Trans proline' 0 C--N 1.343 0.24 0 C-N-CA 122.632 2.222 . . . . 75.11 112.36 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 153' ' ' GLY . . . . . 0.457 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 105.57 -131.76 10.8 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.775 -0.726 . . . . 70.32 112.445 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 154' ' ' ASN . . . . . 0.457 ' C ' ' O ' ' A' ' 153' ' ' GLY . 3.5 p30 -33.37 135.82 0.11 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.851 0.358 . . . . 73.25 110.891 -179.875 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 155' ' ' THR . . . . . 0.524 HG23 ' HA2' ' A' ' 68' ' ' GLY . 0.2 OUTLIER 74.24 101.88 0.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.234 -0.439 . . . . 44.41 111.189 -179.965 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 156' ' ' LEU . . . . . 1.045 HD21 HG21 ' A' ' 186' ' ' ILE . 0.4 OUTLIER -82.41 -56.89 3.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.16 -0.473 . . . . 75.02 110.94 179.98 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 157' ' ' ALA . . . . . 0.527 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -162.87 149.09 12.39 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.245 -0.434 . . . . 71.42 111.131 179.769 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 18.9 p-80 -105.19 126.09 51.71 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.267 -0.424 . . . . 72.02 110.809 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -110.53 153.06 25.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.181 -0.463 . . . . 74.42 111.105 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 15.1 m-85 -108.55 152.25 25.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.23 -0.441 . . . . 75.31 110.877 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 161' ' ' ALA . . . . . 0.712 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -96.66 164.16 18.75 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.617 0.722 . . . . 61.04 111.112 179.935 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 162' ' ' PRO . . . . . 0.712 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.5 Cg_endo -69.76 85.33 0.62 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.672 2.248 . . . . 74.44 112.361 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -134.57 127.63 4.55 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.718 -0.753 . . . . 61.41 112.462 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 2.7 m 72.72 -69.78 0.18 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.847 0.356 . . . . 73.1 111.102 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . 166.61 -59.44 0.23 Allowed Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.767 -0.73 . . . . 74.03 112.454 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 166' ' ' LEU . . . . . 0.484 ' C ' HD23 ' A' ' 166' ' ' LEU . 8.7 tt -53.99 -37.7 64.29 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.741 0.305 . . . . 65.12 110.891 -179.915 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -73.98 -166.19 13.21 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.68 -0.772 . . . . 43.43 112.519 179.85 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 73.01 18.04 78.93 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.642 -0.789 . . . . 74.31 112.483 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 169' ' ' ASP . . . . . 0.494 ' HA ' HG23 ' A' ' 134' ' ' ILE . 74.9 m-20 -91.97 -172.4 3.15 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.796 0.331 . . . . 63.41 110.824 -179.876 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -124.47 131.36 53.49 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.19 -0.459 . . . . 74.21 111.116 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 171' ' ' HIS . . . . . 0.502 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 10.9 m170 -129.0 137.91 51.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.216 -0.447 . . . . 72.53 110.809 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 47.1 m-85 -121.55 140.33 52.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.208 -0.451 . . . . 71.44 110.899 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 55.6 t0 -73.47 100.84 3.35 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.203 -0.453 . . . . 74.11 110.902 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.83 -16.42 11.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.115 -0.493 . . . . 72.25 110.86 -179.886 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -79.03 -16.37 56.94 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.125 -0.489 . . . . 73.32 110.875 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 31.4 mm-40 -83.48 -175.79 5.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.194 -0.457 . . . . 63.2 110.824 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -112.18 116.53 30.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.136 -0.484 . . . . 63.14 110.857 -179.884 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 49.6 m95 -116.82 139.41 50.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.176 -0.466 . . . . 72.31 110.947 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 179' ' ' THR . . . . . 0.515 HG21 ' HB3' ' A' ' 182' ' ' SER . 9.0 t -177.46 163.6 1.99 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.221 -0.445 . . . . 74.13 111.231 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -125.12 -68.86 0.82 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.241 -0.436 . . . . 45.33 110.852 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -64.81 -12.15 52.59 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.706 -0.759 . . . . 62.41 112.523 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 182' ' ' SER . . . . . 0.515 ' HB3' HG21 ' A' ' 179' ' ' THR . 0.4 OUTLIER -94.52 -24.44 17.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.925 0.393 . . . . 64.5 110.876 -179.743 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 183' ' ' SER . . . . . 0.425 ' C ' ' O ' ' A' ' 182' ' ' SER . 3.2 p 35.32 58.03 0.82 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.103 -0.499 . . . . 64.12 110.894 -179.821 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -116.85 -33.53 4.75 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.101 -0.5 . . . . 74.2 110.915 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -119.79 -139.37 5.9 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.696 -0.764 . . . . 73.01 112.414 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 186' ' ' ILE . . . . . 1.045 HG21 HD21 ' A' ' 156' ' ' LEU . 6.9 mm -79.47 100.08 3.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.864 0.364 . . . . 73.22 111.118 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 28.6 m-20 -49.19 121.7 5.18 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.195 -0.457 . . . . 71.31 110.944 179.829 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 188' ' ' PHE . . . . . 0.773 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.5 t80 -54.03 -36.25 62.83 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.196 -0.456 . . . . 75.45 110.884 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 189' ' ' LEU . . . . . 0.59 HD12 ' HE2' ' A' ' 224' ' ' PHE . 0.2 OUTLIER -67.57 -47.62 69.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.139 -0.482 . . . . 52.02 110.867 -179.934 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 44.3 t80 -69.48 -38.94 77.92 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.256 -0.429 . . . . 74.22 110.901 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 191' ' ' ALA . . . . . 0.671 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -72.13 -35.23 69.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.154 -0.475 . . . . 50.03 111.133 179.894 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 192' ' ' ALA . . . . . 0.641 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -57.12 -45.02 83.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.161 -0.472 . . . . 52.11 111.031 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.97 -42.71 90.58 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.231 -0.44 . . . . 72.43 111.181 -179.886 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 194' ' ' HIS . . . . . 0.425 ' HE2' ' CE1' ' A' ' 204' ' ' HIS . 15.0 t-160 -73.21 -38.56 66.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.228 -0.442 . . . . 71.44 110.909 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -75.38 -48.51 22.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 71.01 111.052 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 196' ' ' LEU . . . . . 0.788 HD12 HD12 ' A' ' 113' ' ' LEU . 4.5 mm? -63.81 -40.02 95.63 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.236 -0.438 . . . . 74.51 110.943 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -58.91 -28.59 63.65 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.742 -0.742 . . . . 52.23 112.436 179.863 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 198' ' ' HIS . . . . . 0.473 ' CD2' HG21 ' A' ' 69' ' ' VAL . 7.1 m-70 -69.29 -32.42 71.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.738 0.304 . . . . 75.21 110.793 -179.892 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -70.94 -21.26 62.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.207 -0.451 . . . . 71.13 110.874 -179.748 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 200' ' ' LEU . . . . . 0.502 ' HA ' ' CD1' ' A' ' 84' ' ' TRP . 0.3 OUTLIER -92.54 4.82 52.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.099 -0.501 . . . . 64.13 110.938 -179.984 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 83.37 -9.52 61.23 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.735 -0.745 . . . . 50.41 112.473 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 202' ' ' MET . . . . . 0.434 ' HE2' ' HB3' ' A' ' 202' ' ' MET . 0.0 OUTLIER -54.83 135.0 48.23 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.88 0.372 . . . . 63.21 110.854 -179.99 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -109.79 159.22 14.08 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.768 -0.73 . . . . 64.44 112.409 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 204' ' ' HIS . . . . . 0.425 ' CE1' ' HE2' ' A' ' 194' ' ' HIS . 12.4 m-70 -52.47 155.78 2.02 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.88 0.371 . . . . 74.32 110.837 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 205' ' ' SER . . . . . 0.427 ' HB2' ' HB1' ' A' ' 210' ' ' ALA . 0.5 OUTLIER -117.27 153.01 33.67 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.182 -0.463 . . . . 53.34 110.855 -179.784 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 5.2 p -87.73 -4.9 58.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.157 -0.474 . . . . 72.22 110.859 -179.867 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -71.65 140.53 84.26 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.657 0.741 . . . . 65.11 110.886 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.82 -6.32 18.34 Favored 'Trans proline' 0 C--N 1.342 0.21 0 C-N-CA 122.693 2.262 . . . . 74.53 112.332 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 2.9 p30 -126.85 32.25 5.15 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.23 -0.441 . . . . 63.52 110.874 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 210' ' ' ALA . . . . . 0.492 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.11 146.07 26.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 62.23 111.103 179.845 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -73.63 -27.09 22.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 62.04 111.148 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 212' ' ' MET . . . . . 0.419 ' HE1' ' O ' ' A' ' 202' ' ' MET . 3.2 mmm -97.54 14.1 27.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.194 -0.457 . . . . 75.22 110.876 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 213' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -55.23 121.98 40.23 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-O 121.612 0.72 . . . . 73.43 110.992 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.73 -18.79 36.94 Favored 'Trans proline' 0 N--CA 1.465 -0.203 0 C-N-CA 122.716 2.278 . . . . 63.01 112.364 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 215' ' ' THR . . . . . 0.689 HG22 HD13 ' A' ' 61' ' ' ILE . 5.9 p -84.37 53.28 2.59 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.247 -0.433 . . . . 74.24 111.14 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 8.0 t80 . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.224 -0.444 . . . . 74.14 110.955 -179.978 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 224' ' ' PHE . . . . . 0.59 ' HE2' HD12 ' A' ' 189' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.909 0.385 . . . . 65.01 110.848 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -143.99 -178.19 5.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.185 -0.461 . . . . 64.24 110.875 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 226' ' ' LEU . . . . . 0.867 ' HB3' HD11 ' A' ' 231' ' ' ILE . 0.7 OUTLIER -59.71 148.02 35.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 53.44 110.909 179.925 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 227' ' ' SER . . . . . 0.492 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 1.4 t -90.71 151.62 21.16 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.198 -0.455 . . . . 74.21 110.826 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 42.6 tt0 -67.46 -60.7 2.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.088 -0.505 . . . . 74.54 110.958 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -58.36 -26.08 62.75 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.214 -0.448 . . . . 72.22 110.865 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -69.78 -48.82 57.82 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.19 -0.459 . . . . 74.23 110.904 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 231' ' ' ILE . . . . . 0.867 HD11 ' HB3' ' A' ' 226' ' ' LEU . 10.5 mt -68.63 -44.83 82.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 73.41 111.153 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.2 -32.77 66.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.176 -0.466 . . . . 65.42 110.902 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -64.26 -49.79 63.99 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.703 -0.76 . . . . 63.43 112.456 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 234' ' ' ILE . . . . . 0.492 HD13 HG21 ' A' ' 120' ' ' ILE . 12.8 tt -73.15 -31.82 36.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.72 0.295 . . . . 71.54 111.115 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -62.65 -24.3 67.54 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.142 -0.481 . . . . 70.33 110.895 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 236' ' ' LYS . . . . . 0.449 ' HE3' ' HB2' ' A' ' 237' ' ' LEU . 0.1 OUTLIER -74.66 -22.11 59.06 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.2 -0.455 . . . . 51.21 110.868 179.994 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 237' ' ' LEU . . . . . 0.697 HD22 ' HD2' ' A' ' 83' ' ' LYS . 10.6 tt -97.34 -33.73 11.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.206 -0.452 . . . . 75.41 110.926 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 238' ' ' TYR . . . . . . . . . . . . . 47.4 m-85 -92.04 -35.31 14.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.174 -0.466 . . . . 51.24 110.902 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.355 0 C-N-CA 120.709 -0.757 . . . . 32.22 112.508 179.983 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.515 ' CE2' HD23 ' A' ' 54' ' ' LEU . 16.0 t-105 . . . . . 0 C--O 1.23 0.073 0 CA-C-O 120.73 0.3 . . . . 71.22 110.86 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 78.4 tt0 -62.31 -35.25 78.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.222 -0.445 . . . . 72.51 110.814 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 64.0 mm-40 -74.24 -36.61 63.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.171 -0.468 . . . . 61.24 110.914 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.89 -43.78 78.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.202 -0.453 . . . . 54.34 111.125 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.761 ' HB3' HD21 ' A' ' 35' ' ' LEU . 0.0 OUTLIER -73.07 -32.18 64.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.182 -0.463 . . . . 73.12 110.933 -179.938 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 83.4 m-20 -77.66 -30.91 52.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.174 -0.466 . . . . 72.4 110.898 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.97 -35.69 75.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.153 -0.476 . . . . 75.11 110.938 -179.848 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.661 HD13 ' O ' ' A' ' 19' ' ' LEU . 3.0 tm? -71.26 -21.41 62.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.118 -0.492 . . . . 72.51 110.92 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 4.1 ptmt -75.32 -28.6 59.72 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.188 -0.46 . . . . 74.41 110.919 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.8 ptp180 -86.36 -27.11 24.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.213 -0.448 . . . . 74.05 110.912 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -59.67 -25.32 64.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.181 -0.463 . . . . 74.31 110.877 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.566 ' HB3' HG21 ' A' ' 72' ' ' VAL . 14.5 m-85 . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.125 -0.489 . . . . 72.55 110.924 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.761 HD21 ' HB3' ' A' ' 16' ' ' GLN . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.756 0.312 . . . . 72.52 110.916 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.4 -51.38 63.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.222 -0.444 . . . . 73.13 110.849 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.28 -51.17 68.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.159 -0.473 . . . . 63.32 111.06 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 5.1 mmtt -59.74 -49.48 77.56 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.209 -0.45 . . . . 72.32 110.917 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.461 ' CD2' HD23 ' A' ' 35' ' ' LEU . 0.1 OUTLIER -55.19 -38.74 68.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 72.11 110.964 179.892 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.38 -46.49 88.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 62.43 111.005 179.751 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -70.39 -37.06 74.45 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.173 -0.467 . . . . 75.11 110.925 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 3.2 ttt -68.73 -46.0 70.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.197 -0.456 . . . . 63.43 110.893 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.626 ' HG2' HD11 ' A' ' 48' ' ' LEU . 18.5 mt-30 -57.31 -43.5 83.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.235 -0.439 . . . . 74.45 110.921 179.988 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.6 mmpt? -69.14 -26.73 65.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.213 -0.449 . . . . 71.43 110.86 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -69.99 -36.25 75.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.26 -0.427 . . . . 73.32 110.926 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.561 ' HB3' HD23 ' A' ' 48' ' ' LEU . 6.1 m-85 -80.48 -30.65 37.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.115 -0.493 . . . . 70.43 110.85 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 105.55 -10.55 46.04 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.749 -0.739 . . . . 64.34 112.465 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.626 HD11 ' HG2' ' A' ' 43' ' ' GLN . 0.6 OUTLIER -63.13 140.06 97.62 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.576 0.703 . . . . 64.11 110.938 -179.881 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.75 -51.9 0.36 Allowed 'Trans proline' 0 C--O 1.231 0.169 0 C-N-CA 122.669 2.246 . . . . 74.5 112.325 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.587 HD13 ' HB2' ' A' ' 56' ' ' SER . 0.7 OUTLIER -48.82 108.21 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.238 -0.437 . . . . 71.22 111.146 179.936 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 1.8 t -111.28 159.33 18.04 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.167 -0.47 . . . . 73.25 111.054 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 58.37 17.07 30.71 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.799 -0.715 . . . . 64.24 112.49 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.2 mtp -127.49 161.05 29.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.823 0.344 . . . . 75.23 110.828 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.515 HD23 ' CE2' ' A' ' 12' ' ' TRP . 20.4 tp -154.38 96.81 1.96 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.223 -0.444 . . . . 73.4 110.944 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 177.51 -32.13 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.2 -0.454 . . . . 44.35 110.933 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' SER . . . . . 0.587 ' HB2' HD13 ' A' ' 50' ' ' ILE . 5.0 m -79.51 -100.71 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.162 -0.472 . . . . 75.25 110.795 -179.834 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.0 mmt85 -84.82 -29.4 25.39 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.166 -0.47 . . . . 61.22 110.864 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.517 HG23 HD12 ' A' ' 50' ' ' ILE . 16.3 t -58.84 -44.06 89.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.234 -0.439 . . . . 70.12 111.124 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.416 HD13 ' HA ' ' A' ' 59' ' ' ILE . 3.4 mm -75.51 -31.31 23.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.19 -0.459 . . . . 74.43 111.116 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.94 -44.55 92.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.148 -0.478 . . . . 73.45 110.874 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.428 HD12 ' CZ ' ' A' ' 46' ' ' PHE . 30.3 pt -64.9 -29.89 48.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.196 -0.456 . . . . 74.52 111.117 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 8.1 mmt -65.16 -36.88 85.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.227 -0.442 . . . . 74.01 110.909 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -90.59 -24.59 20.51 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.177 -0.465 . . . . 42.22 110.948 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 2.8 tppt? -84.88 130.76 51.35 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.552 0.692 . . . . 65.34 110.961 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 126.08 12.89 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.657 2.238 . . . . 72.11 112.36 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.42 ' O ' HD23 ' A' ' 156' ' ' LEU . 19.7 ttp180 -122.18 -84.67 0.66 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.191 -0.459 . . . . 71.51 110.883 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -145.96 147.46 31.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.18 -0.464 . . . . 55.3 110.891 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.59 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -98.41 20.85 48.8 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.74 -0.743 . . . . 64.23 112.518 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.516 HG21 ' CD2' ' A' ' 198' ' ' HIS . 0.1 OUTLIER -109.62 130.83 22.35 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.609 0.719 . . . . 74.23 111.165 179.999 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 70' ' ' PRO . . . . . 0.466 ' HB3' ' O ' ' A' ' 23' ' ' TYR . 54.3 Cg_endo -69.79 159.39 53.56 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.647 2.231 . . . . 63.44 112.367 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -113.52 28.62 8.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.237 -0.438 . . . . 74.45 110.872 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.566 HG21 ' HB3' ' A' ' 23' ' ' TYR . 3.2 m . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.165 -0.471 . . . . 53.43 111.163 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo . . . . . 0 C--O 1.231 0.144 0 CA-C-O 120.878 0.282 . . . . 71.11 112.313 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.724 ' HD2' HD13 ' A' ' 237' ' ' LEU . 2.7 mtpt -96.77 164.72 12.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.167 -0.47 . . . . 64.45 110.932 179.877 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' TRP . . . . . 0.699 ' CE3' HG21 ' A' ' 89' ' ' VAL . 40.8 m0 -46.42 110.5 0.28 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.227 -0.442 . . . . 73.31 110.914 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 15.2 t -115.1 1.26 13.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.248 -0.433 . . . . 65.3 111.169 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.4 172.68 3.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.221 -0.445 . . . . 70.34 110.849 -179.837 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.408 ' O ' ' HB3' ' A' ' 123' ' ' HIS . 0.0 OUTLIER -80.4 -30.43 37.77 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.162 -0.472 . . . . 71.12 110.899 179.88 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -159.66 144.83 6.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.449 . . . . 74.14 111.163 179.92 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.699 HG21 ' CE3' ' A' ' 84' ' ' TRP . 12.9 t -127.68 131.92 69.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.252 -0.431 . . . . 72.25 111.15 179.871 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.525 ' C ' ' HB1' ' A' ' 132' ' ' ALA . 22.9 p -115.44 150.51 36.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.222 -0.444 . . . . 71.01 111.165 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 5.7 p90 -130.85 146.41 52.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.191 -0.459 . . . . 70.51 110.931 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 12.6 ttt180 -149.14 137.0 20.54 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.091 -0.504 . . . . 71.25 110.887 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.48 HD11 ' HA ' ' A' ' 106' ' ' ASP . 11.7 mm -75.02 135.25 27.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.153 -0.476 . . . . 72.4 111.157 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.433 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 18.4 t -90.19 -40.51 12.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.189 -0.46 . . . . 60.2 111.105 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 36.2 t -153.94 169.48 23.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.225 -0.443 . . . . 64.24 110.88 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 14.7 p90 -133.07 155.11 49.82 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.111 -0.495 . . . . 72.25 110.954 -179.843 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.9 t -99.43 141.91 31.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.165 -0.471 . . . . 64.11 111.16 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 7.7 ptp85 -52.01 -19.98 2.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.215 -0.448 . . . . 72.14 110.826 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' ASP . . . . . 0.408 ' OD2' HD12 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -70.9 -34.77 71.88 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.261 -0.427 . . . . 74.13 110.808 -179.964 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.645 HD22 HG21 ' A' ' 104' ' ' THR . 6.5 mt -136.08 141.14 35.28 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.628 0.728 . . . . 72.52 110.888 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' PRO . . . . . 0.589 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.8 Cg_endo -69.78 151.0 68.84 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.717 2.278 . . . . 73.11 112.316 179.879 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 2.3 t-160 -53.52 -25.38 16.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.222 -0.445 . . . . 74.11 110.864 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.589 HG22 ' HB2' ' A' ' 101' ' ' PRO . 15.1 tt -77.43 -41.16 29.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.217 -0.447 . . . . 74.02 111.12 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 104' ' ' THR . . . . . 0.793 ' O ' HD22 ' A' ' 108' ' ' LEU . 6.6 m -69.32 -39.05 78.44 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.224 -0.444 . . . . 52.11 111.206 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.8 ' O ' HG13 ' A' ' 109' ' ' VAL . 71.7 t -71.21 -45.5 70.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.157 -0.474 . . . . 71.51 111.112 179.922 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.614 ' O ' HG22 ' A' ' 109' ' ' VAL . 53.6 t0 -63.32 -39.86 95.74 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.196 -0.457 . . . . 63.44 110.854 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 107' ' ' ARG . . . . . 0.497 ' HG3' ' N ' ' A' ' 108' ' ' LEU . 0.1 OUTLIER -70.15 -33.57 71.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.232 -0.44 . . . . 75.02 110.891 -179.865 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.793 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -65.17 -48.47 73.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.133 -0.485 . . . . 71.04 110.887 -179.957 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.8 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.2 m -55.15 -42.49 65.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.226 -0.443 . . . . 72.31 111.144 179.842 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.484 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 30.9 t -70.15 -34.71 73.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.13 -0.487 . . . . 72.14 110.869 -179.854 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.462 ' CG ' HD21 ' A' ' 189' ' ' LEU . 0.3 OUTLIER -62.74 -33.43 75.11 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.124 -0.489 . . . . 74.35 110.895 179.93 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -93.51 -42.08 9.43 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.228 -0.442 . . . . 74.32 111.113 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.732 ' CD1' HD12 ' A' ' 196' ' ' LEU . 0.4 OUTLIER -66.1 -34.14 77.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.243 -0.435 . . . . 72.0 110.958 179.984 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 114' ' ' ASN . . . . . 0.4 ' CB ' ' O ' ' A' ' 110' ' ' SER . 22.2 t30 -68.6 -35.42 77.32 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.148 -0.478 . . . . 72.34 110.862 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 115' ' ' MET . . . . . 0.417 ' O ' ' HG2' ' A' ' 119' ' ' GLU . 0.0 OUTLIER -65.19 -34.14 77.67 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.236 -0.438 . . . . 54.12 110.882 179.923 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 14.6 m95 -67.01 -45.37 77.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.193 -0.458 . . . . 75.23 110.876 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' GLY . . . . . 0.413 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -67.96 -36.5 86.41 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.73 -0.747 . . . . 73.32 112.49 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.26 -17.41 53.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.767 0.317 . . . . 72.42 110.948 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.773 ' HB3' HG23 ' A' ' 231' ' ' ILE . 9.7 mm-40 -99.99 13.46 33.89 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.247 -0.433 . . . . 75.24 110.898 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 1.013 HD12 HD12 ' A' ' 122' ' ' LEU . 7.7 pt -149.28 143.69 17.18 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.521 0.677 . . . . 71.34 111.166 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 26.0 0.18 Allowed 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.625 2.216 . . . . 72.21 112.355 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 1.013 HD12 HD12 ' A' ' 120' ' ' ILE . 12.5 mt -78.99 -161.19 0.28 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 73.22 110.903 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 123' ' ' HIS . . . . . 0.408 ' HB3' ' O ' ' A' ' 87' ' ' LYS . 12.5 t-80 -150.63 121.06 7.37 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.148 -0.478 . . . . 74.12 110.865 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 9.2 m-30 -110.61 147.47 34.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.22 -0.445 . . . . 75.54 110.925 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.424 ' O ' HG22 ' A' ' 90' ' ' THR . 0.0 OUTLIER -131.14 142.07 50.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.455 . . . . 75.14 110.923 -179.946 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.37 160.09 25.51 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.234 -0.439 . . . . 72.22 110.929 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 127' ' ' VAL . . . . . 0.733 HG11 ' HB2' ' A' ' 132' ' ' ALA . 17.8 m -103.29 126.57 57.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.258 -0.428 . . . . 50.13 111.062 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.595 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -146.9 -11.19 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.138 -0.483 . . . . 74.43 111.066 179.966 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 129' ' ' TRP . . . . . 0.595 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -156.78 109.05 2.49 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.203 -0.453 . . . . 71.25 110.95 179.993 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 103.04 -164.93 15.89 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.79 -0.719 . . . . 62.11 112.541 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.97 155.44 18.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.798 0.332 . . . . 63.25 111.122 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 132' ' ' ALA . . . . . 0.733 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -112.46 165.55 12.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.242 -0.436 . . . . 51.34 111.093 179.871 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -76.03 -40.99 52.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.206 -0.452 . . . . 75.41 110.857 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 134' ' ' ILE . . . . . 0.492 HG23 ' O ' ' A' ' 168' ' ' GLY . 3.1 mm -93.93 107.65 19.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.168 -0.469 . . . . 70.51 111.164 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 135' ' ' MET . . . . . 0.433 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 8.1 mmm -99.58 121.55 41.36 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.207 -0.451 . . . . 72.43 110.897 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -106.96 97.15 5.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.252 -0.431 . . . . 70.04 111.125 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -129.85 168.1 21.38 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.728 -0.749 . . . . 63.34 112.466 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 138' ' ' PHE . . . . . 0.591 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 44.4 m-85 -105.25 143.46 33.39 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.808 0.337 . . . . 74.01 110.911 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.591 ' HB2' ' O ' ' A' ' 138' ' ' PHE . . . 168.28 166.27 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.132 -0.486 . . . . 71.21 111.044 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.415 ' HB2' ' HB3' ' A' ' 149' ' ' PHE . 1.5 ptp180 -107.5 174.33 5.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.22 -0.445 . . . . 62.21 110.846 -179.894 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 141' ' ' GLY . . . . . 0.562 ' H ' ' HA ' ' A' ' 149' ' ' PHE . . . -54.4 -17.55 8.49 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.785 -0.721 . . . . 74.24 112.463 -179.911 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 142' ' ' ALA . . . . . 0.558 ' HB2' ' HD2' ' A' ' 149' ' ' PHE . . . -89.17 13.26 13.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.899 0.381 . . . . 75.03 111.115 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 143' ' ' HIS . . . . . 0.433 ' HB3' ' HB1' ' A' ' 139' ' ' ALA . 6.4 p80 -79.71 0.19 31.53 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.217 -0.447 . . . . 71.11 110.858 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 105.49 51.6 0.85 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.725 -0.75 . . . . 45.51 112.447 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -165.76 175.56 8.67 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.788 0.328 . . . . 72.14 110.898 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.93 177.11 0.82 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 51.25 110.9 -179.823 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 64.69 119.31 0.02 OUTLIER Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.71 0.767 . . . . 73.4 110.936 -179.861 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.72 151.3 69.27 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 122.676 2.251 . . . . 74.53 112.38 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 149' ' ' PHE . . . . . 0.562 ' HA ' ' H ' ' A' ' 141' ' ' GLY . 2.0 p90 -53.72 -32.89 53.73 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.246 -0.434 . . . . 63.52 110.894 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 150' ' ' ASP . . . . . 0.519 ' CG ' ' O ' ' A' ' 149' ' ' PHE . 2.8 p30 49.99 15.87 0.2 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.123 -0.49 . . . . 63.11 110.815 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 151' ' ' GLY . . . . . 0.421 ' C ' ' O ' ' A' ' 150' ' ' ASP . . . 36.72 -153.16 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.723 -0.751 . . . . 71.41 112.457 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 143.58 51.42 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.624 2.216 . . . . 75.11 112.354 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 153' ' ' GLY . . . . . 0.445 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 105.11 -132.53 11.14 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.753 -0.737 . . . . 70.32 112.559 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 154' ' ' ASN . . . . . 0.445 ' C ' ' O ' ' A' ' 153' ' ' GLY . 2.1 p30 -34.67 143.39 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.96 0.409 . . . . 73.25 110.8 -179.889 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 155' ' ' THR . . . . . 0.504 HG22 ' CA ' ' A' ' 68' ' ' GLY . 0.2 OUTLIER 67.69 109.58 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.114 -0.494 . . . . 44.41 111.148 -179.991 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 156' ' ' LEU . . . . . 1.028 HD21 HG21 ' A' ' 186' ' ' ILE . 0.8 OUTLIER -88.56 -55.41 3.73 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.253 -0.43 . . . . 75.02 110.928 179.962 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 157' ' ' ALA . . . . . 0.59 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -159.87 148.75 17.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.152 -0.476 . . . . 71.42 111.038 179.81 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 27.3 p-80 -108.25 125.68 51.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.136 -0.484 . . . . 72.02 110.89 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -110.34 166.53 10.91 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.215 -0.448 . . . . 74.42 111.106 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 21.2 m-30 -115.7 147.32 41.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.257 -0.429 . . . . 75.31 110.887 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 161' ' ' ALA . . . . . 0.706 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -79.99 164.28 53.62 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.608 0.718 . . . . 61.04 111.056 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 162' ' ' PRO . . . . . 0.706 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.3 Cg_endo -69.81 71.44 1.54 Allowed 'Trans proline' 0 N--CA 1.465 -0.154 0 C-N-CA 122.742 2.295 . . . . 74.44 112.306 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -127.44 100.31 0.54 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.763 -0.732 . . . . 61.41 112.518 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 66.9 172.35 0.25 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.85 0.357 . . . . 73.1 111.095 -179.85 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -54.35 -37.13 59.13 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.753 -0.737 . . . . 74.03 112.466 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 166' ' ' LEU . . . . . 0.657 HD23 ' O ' ' A' ' 166' ' ' LEU . 4.0 tt -71.26 -19.64 62.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.792 0.33 . . . . 65.12 110.945 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -93.57 144.64 17.21 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.757 -0.735 . . . . 43.43 112.496 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 168' ' ' GLY . . . . . 0.492 ' O ' HG23 ' A' ' 134' ' ' ILE . . . 102.75 13.04 30.85 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.778 -0.725 . . . . 74.31 112.5 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 29.4 m-20 -82.62 167.62 18.11 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.856 0.36 . . . . 63.41 110.86 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -125.75 130.68 51.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.208 -0.451 . . . . 74.21 111.114 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 171' ' ' HIS . . . . . 0.576 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 23.1 m170 -130.66 132.05 45.21 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.286 -0.415 . . . . 72.53 110.887 179.954 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -115.8 139.41 50.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 71.44 110.859 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 48.3 t0 -71.31 99.77 2.01 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.121 -0.49 . . . . 74.11 110.854 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 1.6 pp20? -57.21 -16.99 9.42 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.231 -0.441 . . . . 72.25 110.913 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -76.36 -16.21 59.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.17 -0.468 . . . . 73.32 110.887 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 23.6 mm-40 -84.34 -174.62 5.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.2 -0.455 . . . . 63.2 110.903 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 12.2 mtt85 -116.49 116.26 27.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.189 -0.46 . . . . 63.14 110.828 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 178' ' ' TRP . . . . . 0.405 ' CE3' ' HB ' ' A' ' 186' ' ' ILE . 13.0 m95 -116.95 146.29 43.08 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.135 -0.484 . . . . 72.31 110.854 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 179' ' ' THR . . . . . 0.576 HG21 ' HB3' ' A' ' 182' ' ' SER . 7.4 t -178.93 163.8 1.41 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.25 -0.432 . . . . 74.13 111.14 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -123.49 -68.11 0.89 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.45 . . . . 45.33 110.901 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -66.63 -10.83 55.68 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.829 -0.701 . . . . 62.41 112.475 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 182' ' ' SER . . . . . 0.576 ' HB3' HG21 ' A' ' 179' ' ' THR . 0.3 OUTLIER -97.32 -24.43 15.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.911 0.386 . . . . 64.5 110.842 -179.716 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 183' ' ' SER . . . . . 0.455 ' C ' ' O ' ' A' ' 182' ' ' SER . 2.9 p 33.33 60.99 0.45 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.107 -0.497 . . . . 64.12 110.926 -179.754 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 16.5 tp -116.85 -33.57 4.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.114 -0.494 . . . . 74.2 110.921 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -121.58 -137.4 5.22 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.747 -0.739 . . . . 73.01 112.514 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 186' ' ' ILE . . . . . 1.028 HG21 HD21 ' A' ' 156' ' ' LEU . 6.6 mm -79.47 99.92 3.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.827 0.346 . . . . 73.22 111.165 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 27.1 m120 -50.93 121.98 6.8 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.2 -0.454 . . . . 71.31 110.85 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 188' ' ' PHE . . . . . 0.782 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.6 t80 -53.93 -35.7 61.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.136 -0.484 . . . . 75.45 110.886 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 189' ' ' LEU . . . . . 0.462 HD21 ' CG ' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -67.21 -47.6 70.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.181 -0.463 . . . . 52.02 110.881 -179.958 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 6.2 t80 -69.52 -37.26 77.07 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.165 -0.47 . . . . 74.22 110.944 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 191' ' ' ALA . . . . . 0.563 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -72.65 -35.78 67.84 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.098 -0.501 . . . . 50.03 111.071 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 192' ' ' ALA . . . . . 0.739 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -61.48 -44.59 96.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.247 -0.433 . . . . 52.11 111.107 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 193' ' ' THR . . . . . 0.51 HG21 HG21 ' A' ' 211' ' ' VAL . 17.7 m -58.52 -45.22 89.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.172 -0.467 . . . . 72.43 111.136 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 20.8 t-160 -72.59 -40.11 66.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.181 -0.463 . . . . 71.44 110.838 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -71.02 -47.0 61.16 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.232 -0.44 . . . . 71.01 111.165 179.901 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 196' ' ' LEU . . . . . 0.739 HD23 ' O ' ' A' ' 192' ' ' ALA . 4.5 mm? -64.88 -38.88 92.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.225 -0.443 . . . . 74.51 110.898 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -62.48 -26.69 68.46 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.673 -0.775 . . . . 52.23 112.483 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 198' ' ' HIS . . . . . 0.516 ' CD2' HG21 ' A' ' 69' ' ' VAL . 4.6 m-70 -65.24 -41.47 94.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.864 0.364 . . . . 75.21 110.93 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 199' ' ' SER . . . . . 0.479 ' HG ' ' HZ2' ' A' ' 84' ' ' TRP . 31.9 t -64.57 -22.4 66.96 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.134 -0.485 . . . . 71.13 110.893 -179.782 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 2.4 mt -83.11 -2.55 55.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.059 -0.519 . . . . 64.13 110.865 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 84.09 4.7 88.19 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.715 -0.755 . . . . 50.41 112.501 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 202' ' ' MET . . . . . 0.423 ' CE ' ' HB ' ' A' ' 234' ' ' ILE . 43.8 tpp -65.82 144.61 56.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.836 0.35 . . . . 63.21 110.874 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -106.19 159.09 15.24 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.761 -0.733 . . . . 64.44 112.546 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 27.2 m-70 -58.1 166.12 1.68 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.796 0.332 . . . . 74.32 110.913 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 2.1 t -128.56 149.18 50.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.24 -0.436 . . . . 53.34 110.825 -179.758 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 1.1 m -88.07 -4.28 58.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.081 -0.509 . . . . 72.22 110.843 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 207' ' ' ASP . . . . . 0.429 ' O ' ' CD1' ' A' ' 213' ' ' TYR . 0.1 OUTLIER -71.27 135.51 84.51 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.59 0.709 . . . . 65.11 110.845 -179.962 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.7 -7.7 21.72 Favored 'Trans proline' 0 C--O 1.231 0.148 0 C-N-CA 122.691 2.26 . . . . 74.53 112.352 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 -127.53 24.27 6.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.258 -0.428 . . . . 63.52 110.89 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 210' ' ' ALA . . . . . 0.445 ' O ' ' HB2' ' A' ' 213' ' ' TYR . . . -87.55 145.76 26.08 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.112 -0.495 . . . . 62.23 111.113 179.831 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 211' ' ' VAL . . . . . 0.51 HG21 HG21 ' A' ' 193' ' ' THR . 0.4 OUTLIER -68.44 -24.94 30.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.144 -0.48 . . . . 62.04 111.146 -179.985 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 1.5 mpp? -95.09 9.7 38.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.464 . . . . 75.22 110.885 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 213' ' ' TYR . . . . . 0.445 ' HB2' ' O ' ' A' ' 210' ' ' ALA . 1.8 t80 -55.06 116.75 12.15 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.689 0.757 . . . . 73.43 110.961 -179.884 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.81 -17.98 37.02 Favored 'Trans proline' 0 C--O 1.232 0.208 0 C-N-CA 122.639 2.226 . . . . 63.01 112.353 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -83.93 2.85 36.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.251 -0.431 . . . . 74.24 111.132 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 1.2 t80 . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 116.239 -0.437 . . . . 74.14 110.901 -179.967 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.105 0 CA-C-O 120.929 0.395 . . . . 65.01 110.899 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.87 169.32 18.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.096 -0.502 . . . . 64.24 110.914 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 226' ' ' LEU . . . . . 0.754 HD13 ' HG3' ' A' ' 119' ' ' GLU . 0.9 OUTLIER -59.83 150.73 27.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.205 -0.452 . . . . 53.44 110.898 179.935 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 227' ' ' SER . . . . . 0.445 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 9.8 t -85.4 159.12 20.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.173 -0.467 . . . . 74.21 110.866 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -64.24 -67.24 0.45 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.163 -0.472 . . . . 74.54 110.926 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -55.12 -25.68 33.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.164 -0.471 . . . . 72.22 110.935 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 230' ' ' ASP . . . . . 0.62 ' OD2' HD23 ' A' ' 226' ' ' LEU . 9.9 t0 -69.09 -48.47 62.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.184 -0.462 . . . . 74.23 110.814 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 231' ' ' ILE . . . . . 0.773 HG23 ' HB3' ' A' ' 119' ' ' GLU . 10.2 mt -68.22 -42.94 85.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.216 -0.447 . . . . 73.41 111.137 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 35.4 pttt -65.14 -32.25 73.85 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.164 -0.471 . . . . 65.42 110.872 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -62.8 -48.89 77.51 Favored Glycine 0 C--N 1.33 0.225 0 C-N-CA 120.704 -0.76 . . . . 63.43 112.449 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 234' ' ' ILE . . . . . 0.423 ' HB ' ' CE ' ' A' ' 202' ' ' MET . 11.4 tt -73.05 -31.95 37.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.782 0.325 . . . . 71.54 111.095 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -67.69 -32.71 73.55 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.225 -0.443 . . . . 70.33 110.873 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 236' ' ' LYS . . . . . 0.45 ' HE3' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.17 -22.01 59.6 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.187 -0.46 . . . . 51.21 110.907 179.964 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 237' ' ' LEU . . . . . 0.724 HD13 ' HD2' ' A' ' 83' ' ' LYS . 5.7 tt -97.62 -28.2 14.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.264 -0.425 . . . . 75.41 110.957 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 238' ' ' TYR . . . . . 0.488 ' CE2' HD11 ' A' ' 122' ' ' LEU . 4.4 m-85 -92.12 -35.67 13.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.145 -0.48 . . . . 51.24 110.964 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.327 0 C-N-CA 120.72 -0.752 . . . . 32.22 112.508 179.952 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 13.0 t-105 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.697 0.284 . . . . 71.22 110.908 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -60.24 -35.27 75.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.301 -0.409 . . . . 72.51 110.869 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.94 -36.63 84.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.151 -0.477 . . . . 61.24 110.905 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.13 -35.85 69.97 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.257 -0.429 . . . . 54.34 111.112 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.467 ' OE1' HD22 ' A' ' 35' ' ' LEU . 1.5 tt0 -72.49 -42.95 64.32 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.222 -0.444 . . . . 73.12 110.91 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.68 -32.64 74.08 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.201 -0.454 . . . . 72.4 110.938 179.91 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -70.02 -41.87 73.74 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 75.11 110.933 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.705 HD21 ' HG3' ' A' ' 42' ' ' MET . 6.5 mt -71.64 -32.82 68.37 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.131 -0.486 . . . . 72.51 110.841 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.45 ' HE2' ' HA ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -57.04 -37.53 71.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.217 -0.447 . . . . 74.41 110.885 179.918 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.45 ' HA ' ' HE2' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -85.01 -26.62 26.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.201 -0.454 . . . . 74.05 110.869 179.968 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.423 ' HB2' ' HA ' ' A' ' 19' ' ' LEU . 1.5 m-85 -59.53 -38.6 81.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.147 -0.478 . . . . 74.31 110.852 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.57 ' HE2' HD22 ' A' ' 19' ' ' LEU . 2.4 p90 . . . . . 0 C--N 1.328 -0.346 0 CA-C-N 116.189 -0.46 . . . . 72.55 110.936 -179.868 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.598 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 32.5 tp . . . . . 0 C--O 1.23 0.062 0 CA-C-O 120.794 0.331 . . . . 72.52 110.927 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -57.14 -51.11 70.61 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.127 -0.488 . . . . 73.13 110.858 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.65 -36.33 83.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.172 -0.467 . . . . 63.32 111.153 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.404 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.2 OUTLIER -66.51 -49.07 67.75 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.16 -0.473 . . . . 72.32 110.945 179.945 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.801 HD13 HD23 ' A' ' 54' ' ' LEU . 11.3 mt -54.62 -38.2 66.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.268 -0.424 . . . . 72.11 110.925 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.7 mmmt -59.44 -45.87 90.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.159 -0.473 . . . . 62.43 110.877 179.865 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.404 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 3.3 pt-20 -69.91 -33.78 72.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.203 -0.453 . . . . 75.11 110.9 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.746 ' HE1' HD11 ' A' ' 61' ' ' ILE . 0.3 OUTLIER -68.47 -46.86 68.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.111 -0.495 . . . . 63.43 110.902 179.959 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.559 ' HB3' HG22 ' A' ' 51' ' ' THR . 1.7 mt-30 -57.66 -40.34 79.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.27 -0.423 . . . . 74.45 110.941 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.0 mmpt? -69.82 -25.7 63.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.255 -0.429 . . . . 71.43 110.877 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -70.08 -36.07 74.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.241 -0.436 . . . . 73.32 110.89 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.628 ' CZ ' HD12 ' A' ' 61' ' ' ILE . 28.2 m-85 -80.49 -27.17 37.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.146 -0.479 . . . . 70.43 110.882 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.434 ' HA2' ' HB2' ' A' ' 206' ' ' SER . . . 102.53 -10.3 56.15 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.716 -0.754 . . . . 64.34 112.479 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.549 HD11 ' CG ' ' A' ' 43' ' ' GLN . 0.8 OUTLIER -65.56 140.52 97.57 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.566 0.698 . . . . 64.11 110.899 -179.927 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.665 ' O ' HG23 ' A' ' 51' ' ' THR . 54.7 Cg_endo -69.73 -54.4 0.22 Allowed 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.662 2.241 . . . . 74.5 112.435 179.79 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.558 HD12 ' CG2' ' A' ' 58' ' ' VAL . 0.8 OUTLIER -50.4 108.25 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.189 -0.46 . . . . 71.22 111.166 179.865 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.665 HG23 ' O ' ' A' ' 49' ' ' PRO . 73.6 p -121.96 159.04 27.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.189 -0.46 . . . . 73.25 111.178 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 82.92 -10.69 56.87 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.79 -0.719 . . . . 64.24 112.439 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' MET . . . . . 0.421 ' O ' HG21 ' A' ' 58' ' ' VAL . 30.5 mtp -135.22 161.12 36.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.808 0.337 . . . . 75.23 110.842 -179.909 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.801 HD23 HD13 ' A' ' 39' ' ' LEU . 1.4 pp -160.15 129.42 5.09 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.192 -0.458 . . . . 73.4 110.967 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 p30 172.0 -29.04 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.193 -0.458 . . . . 44.35 110.924 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 2.7 m -97.54 -85.38 0.36 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.188 -0.46 . . . . 75.25 110.806 -179.861 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.595 ' O ' HG23 ' A' ' 61' ' ' ILE . 18.6 tpt180 -84.46 -39.34 19.05 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.12 -0.491 . . . . 61.22 110.859 -179.927 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.558 ' CG2' HD12 ' A' ' 50' ' ' ILE . 15.8 t -59.01 -43.94 90.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.261 -0.427 . . . . 70.12 111.064 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -74.38 -31.17 27.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.23 -0.441 . . . . 74.43 111.133 179.898 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.77 -33.06 71.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.465 . . . . 73.45 110.872 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.746 HD11 ' HE1' ' A' ' 42' ' ' MET . 0.6 OUTLIER -69.94 -29.68 41.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.137 -0.483 . . . . 74.52 111.128 -179.956 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 10.8 mtt -68.04 -35.17 77.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.178 -0.465 . . . . 74.01 110.888 179.814 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -86.9 -24.05 24.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.234 -0.439 . . . . 42.22 110.912 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.31 123.26 73.35 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.639 0.733 . . . . 65.34 110.801 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.77 147.2 62.27 Favored 'Trans proline' 0 N--CA 1.465 -0.181 0 C-N-CA 122.693 2.262 . . . . 72.11 112.373 179.879 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.507 ' O ' HD23 ' A' ' 156' ' ' LEU . 0.2 OUTLIER -150.4 -76.34 0.15 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.245 -0.434 . . . . 71.51 110.88 -179.895 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -144.94 153.94 42.06 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.166 -0.47 . . . . 55.3 110.874 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.53 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -103.97 24.07 30.47 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.736 -0.745 . . . . 64.23 112.501 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.622 HG21 ' CD2' ' A' ' 198' ' ' HIS . 0.2 OUTLIER -104.96 136.71 19.13 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 121.65 0.738 . . . . 74.23 111.063 -179.963 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 70' ' ' PRO . . . . . 0.584 ' HD2' HG12 ' A' ' 69' ' ' VAL . 53.8 Cg_endo -69.71 162.21 42.92 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.683 2.255 . . . . 63.44 112.333 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -128.59 43.03 3.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.206 -0.452 . . . . 74.45 110.842 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.178 -0.464 . . . . 53.43 111.115 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo . . . . . 0 C--O 1.231 0.172 0 CA-C-O 120.864 0.277 . . . . 71.11 112.306 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.683 ' CD ' HD13 ' A' ' 237' ' ' LEU . 2.3 mttp -77.72 171.4 15.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.239 -0.437 . . . . 64.45 110.922 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' TRP . . . . . 0.425 ' CD1' ' HA ' ' A' ' 200' ' ' LEU . 75.9 m95 -66.38 134.84 53.39 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.23 -0.441 . . . . 73.31 110.9 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 5.5 t -115.26 1.36 13.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.259 -0.428 . . . . 65.3 111.172 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -74.95 -178.85 3.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.252 -0.431 . . . . 70.34 110.842 -179.881 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 15.2 mttt -103.08 -8.78 20.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.136 -0.484 . . . . 71.12 110.861 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -153.54 144.92 14.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.258 -0.428 . . . . 74.14 111.097 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 97.4 t -123.62 130.34 74.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.171 -0.468 . . . . 72.25 111.118 179.91 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -116.2 156.34 26.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.164 -0.471 . . . . 71.01 111.097 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 4.8 p90 -147.09 146.84 30.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.254 -0.43 . . . . 70.51 110.967 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -151.15 135.56 16.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.1 -0.5 . . . . 71.25 110.832 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.434 HD11 ' HA ' ' A' ' 106' ' ' ASP . 13.7 mm -75.27 131.67 34.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.185 -0.461 . . . . 72.4 111.144 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.407 ' HB ' ' HA3' ' A' ' 137' ' ' GLY . 16.4 t -88.34 -40.21 13.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.462 . . . . 60.2 111.1 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 3.4 t -151.46 169.63 21.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.186 -0.461 . . . . 64.24 110.803 -179.827 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 11.5 p90 -130.16 154.16 47.8 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.124 -0.489 . . . . 72.25 110.909 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 3.4 t -102.3 141.64 34.8 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.099 -0.5 . . . . 64.11 111.109 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 4.8 mmp_? -52.63 -17.95 1.54 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.187 -0.46 . . . . 72.14 110.937 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.88 -36.87 85.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.156 -0.475 . . . . 74.13 110.862 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.418 HD11 ' HA ' ' A' ' 179' ' ' THR . 1.7 mp -143.13 152.11 57.27 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-O 121.617 0.722 . . . . 72.52 110.932 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 101' ' ' PRO . . . . . 0.574 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.9 Cg_endo -69.71 151.03 69.27 Favored 'Trans proline' 0 C--O 1.233 0.226 0 C-N-CA 122.694 2.262 . . . . 73.11 112.38 179.866 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 3.3 t-160 -52.96 -26.59 15.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.251 -0.431 . . . . 74.11 110.91 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.574 HG22 ' HB2' ' A' ' 101' ' ' PRO . 0.0 OUTLIER -76.46 -39.23 33.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.178 -0.464 . . . . 74.02 111.078 -179.999 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 104' ' ' THR . . . . . 0.632 ' O ' HD22 ' A' ' 108' ' ' LEU . 3.0 m -69.47 -39.67 77.56 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.146 -0.479 . . . . 52.11 111.11 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.781 ' O ' HG13 ' A' ' 109' ' ' VAL . 72.4 t -72.74 -46.37 53.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.302 -0.408 . . . . 71.51 111.114 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.658 ' O ' HG22 ' A' ' 109' ' ' VAL . 59.7 t0 -58.45 -45.53 88.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.17 -0.468 . . . . 63.44 110.845 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 12.2 ptm180 -70.39 -34.08 72.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.222 -0.445 . . . . 75.02 110.797 -179.785 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.632 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -60.87 -48.68 80.69 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.234 -0.439 . . . . 71.04 110.97 -179.999 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.781 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.5 m -55.33 -41.47 61.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.152 -0.476 . . . . 72.31 111.11 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.462 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 47.0 t -70.11 -33.35 71.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.15 -0.477 . . . . 72.14 110.81 -179.775 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.431 ' HB3' HD21 ' A' ' 189' ' ' LEU . 0.4 OUTLIER -61.56 -32.92 73.02 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.165 -0.47 . . . . 74.35 110.864 179.952 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.81 -40.15 9.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.246 -0.434 . . . . 74.32 111.134 179.773 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.82 ' CD1' HD12 ' A' ' 196' ' ' LEU . 0.6 OUTLIER -65.1 -33.4 75.94 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.218 -0.446 . . . . 72.0 110.884 -179.945 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -70.45 -42.63 71.26 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.208 -0.451 . . . . 72.34 110.884 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 115' ' ' MET . . . . . 0.482 ' O ' HD11 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -57.5 -34.75 69.4 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.18 -0.464 . . . . 54.12 110.818 179.926 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 14.6 m95 -61.46 -50.12 74.04 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.252 -0.431 . . . . 75.23 110.906 -179.909 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 117' ' ' GLY . . . . . 0.599 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -73.08 -27.48 68.41 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.768 -0.73 . . . . 73.32 112.406 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.2 mmpt? -63.22 -15.18 56.23 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.791 0.329 . . . . 72.42 110.928 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.525 ' HG3' HG21 ' A' ' 231' ' ' ILE . 0.4 OUTLIER -107.57 14.08 26.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.189 -0.46 . . . . 75.24 110.862 -179.985 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 0.994 HD12 HD12 ' A' ' 122' ' ' LEU . 7.3 pt -147.08 155.64 47.06 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 121.668 0.747 . . . . 71.34 111.101 -180.0 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.76 3.7 2.62 Favored 'Trans proline' 0 C--N 1.342 0.226 0 C-N-CA 122.633 2.222 . . . . 72.21 112.391 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.994 HD12 HD12 ' A' ' 120' ' ' ILE . 4.6 mt -60.59 -155.37 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.232 -0.44 . . . . 73.22 110.981 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 16.9 t-80 -167.81 149.0 5.31 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.266 -0.424 . . . . 74.12 110.86 179.87 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 124' ' ' PHE . . . . . 0.546 ' CD2' HD21 ' A' ' 113' ' ' LEU . 43.9 m-85 -129.41 148.67 51.35 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.223 -0.444 . . . . 75.54 110.841 -179.901 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.421 ' HG2' ' N ' ' A' ' 126' ' ' LYS . 0.4 OUTLIER -126.22 143.19 51.23 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.13 -0.487 . . . . 75.14 110.919 -179.971 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 126' ' ' LYS . . . . . 0.421 ' N ' ' HG2' ' A' ' 125' ' ' ARG . 0.0 OUTLIER -80.7 140.34 35.65 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.201 -0.454 . . . . 72.22 110.875 -179.999 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 127' ' ' VAL . . . . . 0.899 HG11 ' HB2' ' A' ' 132' ' ' ALA . 16.6 m -102.85 129.81 53.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.468 . . . . 50.13 111.082 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.467 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -142.31 -22.61 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.156 -0.475 . . . . 74.43 111.127 179.916 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 129' ' ' TRP . . . . . 0.467 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -139.01 109.18 6.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.146 -0.479 . . . . 71.25 110.88 -179.975 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 108.43 -160.73 13.61 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.711 -0.757 . . . . 62.11 112.466 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -102.0 155.56 18.09 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.795 0.331 . . . . 63.25 111.139 -179.862 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 132' ' ' ALA . . . . . 0.899 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -112.23 165.47 12.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.201 -0.454 . . . . 51.34 111.057 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -71.53 -58.22 3.7 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.176 -0.466 . . . . 75.41 110.842 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 134' ' ' ILE . . . . . 0.418 HG22 ' CD1' ' A' ' 136' ' ' ILE . 16.8 mm -85.11 107.96 16.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.226 -0.443 . . . . 70.51 111.123 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 8.4 mmm -95.29 121.0 36.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.152 -0.477 . . . . 72.43 110.869 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.418 ' CD1' HG22 ' A' ' 134' ' ' ILE . 0.7 OUTLIER -106.9 97.79 6.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.306 -0.407 . . . . 70.04 111.099 -179.997 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 137' ' ' GLY . . . . . 0.407 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -129.36 165.96 21.83 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.725 -0.75 . . . . 63.34 112.533 179.867 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 138' ' ' PHE . . . . . 0.557 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 82.4 m-85 -105.27 141.45 36.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.859 0.362 . . . . 74.01 110.893 -179.846 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.557 ' HB2' ' O ' ' A' ' 138' ' ' PHE . . . 170.24 165.84 0.06 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.119 -0.491 . . . . 71.21 111.092 179.986 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.42 ' HB2' ' HB3' ' A' ' 149' ' ' PHE . 7.2 ptt180 -105.99 174.08 6.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.194 -0.457 . . . . 62.21 110.849 -179.888 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 141' ' ' GLY . . . . . 0.536 ' H ' ' HA ' ' A' ' 149' ' ' PHE . . . -55.71 -16.76 12.44 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.716 -0.754 . . . . 74.24 112.46 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 142' ' ' ALA . . . . . 0.618 ' HB2' ' CD2' ' A' ' 149' ' ' PHE . . . -91.84 13.12 19.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.86 0.362 . . . . 75.03 111.117 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 143' ' ' HIS . . . . . 0.482 ' HB3' ' HB1' ' A' ' 139' ' ' ALA . 4.3 p80 -79.21 -2.07 39.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.199 -0.455 . . . . 71.11 110.86 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 107.92 49.1 0.85 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.751 -0.738 . . . . 45.51 112.523 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -163.59 174.59 11.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.848 0.356 . . . . 72.14 110.802 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 47.1 p -63.9 -179.61 0.42 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.172 -0.467 . . . . 51.25 110.853 -179.781 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 65.34 119.97 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.627 0.727 . . . . 73.4 110.955 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.8 141.41 45.02 Favored 'Trans proline' 0 C--O 1.232 0.186 0 C-N-CA 122.734 2.29 . . . . 74.53 112.328 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 149' ' ' PHE . . . . . 0.618 ' CD2' ' HB2' ' A' ' 142' ' ' ALA . 3.4 p90 -54.23 -40.71 67.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.275 -0.421 . . . . 63.52 110.879 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 150' ' ' ASP . . . . . 0.482 ' CG ' ' O ' ' A' ' 149' ' ' PHE . 2.8 p30 49.16 19.19 0.28 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.106 -0.497 . . . . 63.11 110.891 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 151' ' ' GLY . . . . . 0.423 ' C ' ' O ' ' A' ' 150' ' ' ASP . . . 35.97 -147.53 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.785 -0.721 . . . . 71.41 112.495 -179.942 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.68 145.27 57.09 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.721 2.28 . . . . 75.11 112.325 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 153' ' ' GLY . . . . . 0.456 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 106.45 -138.99 14.67 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.803 -0.713 . . . . 70.32 112.52 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 154' ' ' ASN . . . . . 0.456 ' C ' ' O ' ' A' ' 153' ' ' GLY . 3.7 p30 -33.8 136.05 0.12 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.896 0.379 . . . . 73.25 110.88 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 155' ' ' THR . . . . . 0.417 HG23 ' HA2' ' A' ' 68' ' ' GLY . 0.6 OUTLIER 77.19 115.91 0.06 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.2 -0.455 . . . . 44.41 111.114 -179.964 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 156' ' ' LEU . . . . . 0.993 HD21 HG21 ' A' ' 186' ' ' ILE . 0.6 OUTLIER -94.53 -53.39 3.92 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.209 -0.45 . . . . 75.02 110.894 179.961 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 157' ' ' ALA . . . . . 0.558 ' HB1' ' O ' ' A' ' 171' ' ' HIS . . . -163.97 149.32 10.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.178 -0.464 . . . . 71.42 111.069 179.818 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 29.3 p-80 -109.13 123.6 49.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.256 -0.429 . . . . 72.02 110.903 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -110.54 152.6 26.19 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.248 -0.433 . . . . 74.42 111.067 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -108.01 169.85 8.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.191 -0.459 . . . . 75.31 110.862 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 161' ' ' ALA . . . . . 0.706 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -107.98 164.23 15.23 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-O 121.624 0.726 . . . . 61.04 111.149 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 162' ' ' PRO . . . . . 0.706 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.9 Cg_endo -69.86 90.06 0.53 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.688 2.259 . . . . 74.44 112.315 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -144.43 141.72 10.36 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.779 -0.724 . . . . 61.41 112.514 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 74.3 m 64.79 -81.31 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.82 0.343 . . . . 73.1 111.135 -179.834 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -179.52 -70.19 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.721 -0.752 . . . . 74.03 112.489 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 166' ' ' LEU . . . . . 0.799 HD22 ' C ' ' A' ' 166' ' ' LEU . 0.0 OUTLIER -54.0 -21.57 8.49 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.815 0.341 . . . . 65.12 110.848 -179.9 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 167' ' ' GLY . . . . . 0.727 ' N ' HD22 ' A' ' 166' ' ' LEU . . . -80.38 -173.84 46.91 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.732 -0.747 . . . . 43.43 112.543 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 72.8 22.26 79.18 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.775 -0.726 . . . . 74.31 112.444 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -95.93 -174.21 3.05 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.798 0.333 . . . . 63.41 110.858 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -124.71 131.42 53.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.128 -0.487 . . . . 74.21 111.064 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 171' ' ' HIS . . . . . 0.558 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 18.8 m170 -125.92 132.37 52.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.206 -0.452 . . . . 72.53 110.882 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 -114.35 140.26 48.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.195 -0.457 . . . . 71.44 110.911 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 57.8 t0 -73.43 101.59 3.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.138 -0.483 . . . . 74.11 110.881 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.34 -16.21 13.51 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.16 -0.473 . . . . 72.25 110.876 -179.892 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -79.11 -16.16 57.1 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.123 -0.49 . . . . 73.32 110.796 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 37.8 mm-40 -83.61 -175.88 6.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.262 -0.427 . . . . 63.2 110.922 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 54.4 mtm180 -111.59 116.86 31.52 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.225 -0.443 . . . . 63.14 110.881 -179.937 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 52.1 m95 -116.96 139.89 50.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.203 -0.453 . . . . 72.31 110.959 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 179' ' ' THR . . . . . 0.442 HG21 ' HB3' ' A' ' 182' ' ' SER . 12.7 t -178.11 163.5 1.71 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.236 -0.438 . . . . 74.13 111.142 -179.961 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -125.32 -70.13 0.76 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.29 -0.413 . . . . 45.33 110.946 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -62.83 -13.57 47.67 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.784 -0.722 . . . . 62.41 112.5 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 182' ' ' SER . . . . . 0.442 ' HB3' HG21 ' A' ' 179' ' ' THR . 0.4 OUTLIER -93.58 -24.41 17.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.859 0.361 . . . . 64.5 110.806 -179.677 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 183' ' ' SER . . . . . 0.422 ' C ' ' O ' ' A' ' 182' ' ' SER . 4.5 m 35.67 57.61 0.9 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.127 -0.488 . . . . 64.12 110.824 -179.776 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 184' ' ' LEU . . . . . 0.408 ' O ' HD23 ' A' ' 184' ' ' LEU . 4.2 tt -116.86 -33.62 4.72 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.124 -0.489 . . . . 74.2 110.837 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -117.99 -140.22 6.43 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.809 -0.71 . . . . 73.01 112.528 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 186' ' ' ILE . . . . . 0.993 HG21 HD21 ' A' ' 156' ' ' LEU . 5.5 mm -79.65 98.58 3.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 120.873 0.368 . . . . 73.22 111.149 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -47.09 120.52 3.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.15 -0.477 . . . . 71.31 110.892 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 188' ' ' PHE . . . . . 0.746 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.4 t80 -54.07 -35.41 62.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.137 -0.483 . . . . 75.45 110.902 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 189' ' ' LEU . . . . . 0.593 HD12 ' CD2' ' A' ' 224' ' ' PHE . 0.2 OUTLIER -67.11 -48.0 69.47 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.077 -0.51 . . . . 52.02 110.946 -179.95 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -70.22 -40.23 74.63 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.152 -0.476 . . . . 74.22 110.906 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 191' ' ' ALA . . . . . 0.67 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -70.62 -35.07 72.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.143 -0.48 . . . . 50.03 111.08 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 192' ' ' ALA . . . . . 0.6 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -56.62 -44.62 81.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.246 -0.433 . . . . 52.11 111.114 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 193' ' ' THR . . . . . 0.504 HG21 ' HE1' ' A' ' 224' ' ' PHE . 0.2 OUTLIER -58.47 -42.37 87.34 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.285 -0.416 . . . . 72.43 111.109 -179.931 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 14.5 t-160 -73.36 -42.06 62.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.263 -0.426 . . . . 71.44 110.755 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -72.09 -48.59 42.91 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.299 -0.409 . . . . 71.01 111.132 179.89 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 196' ' ' LEU . . . . . 0.82 HD12 ' CD1' ' A' ' 113' ' ' LEU . 4.4 mm? -65.73 -43.45 88.99 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.218 -0.447 . . . . 74.51 110.965 -179.955 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -57.34 -28.37 59.04 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.68 -0.771 . . . . 52.23 112.527 179.87 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 198' ' ' HIS . . . . . 0.622 ' CD2' HG21 ' A' ' 69' ' ' VAL . 6.1 m-70 -65.87 -32.84 74.58 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.777 0.322 . . . . 75.21 110.88 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -69.77 -20.84 63.47 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.265 -0.425 . . . . 71.13 110.847 -179.802 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 200' ' ' LEU . . . . . 0.425 ' HA ' ' CD1' ' A' ' 84' ' ' TRP . 0.3 OUTLIER -89.78 5.56 45.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.139 -0.482 . . . . 64.13 110.916 -179.98 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 83.6 -7.52 68.82 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.704 -0.76 . . . . 50.41 112.577 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 202' ' ' MET . . . . . . . . . . . . . 45.4 tpp -55.27 135.24 49.99 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.797 0.332 . . . . 63.21 110.853 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -113.53 158.94 13.97 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.75 -0.738 . . . . 64.44 112.465 -179.958 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 204' ' ' HIS . . . . . 0.404 ' HA ' ' HG3' ' A' ' 212' ' ' MET . 11.2 m170 -55.15 150.76 10.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.793 0.33 . . . . 74.32 110.86 -179.92 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -117.51 162.57 17.76 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.149 -0.478 . . . . 53.34 110.84 -179.751 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 206' ' ' SER . . . . . 0.434 ' HB2' ' HA2' ' A' ' 47' ' ' GLY . 2.0 p -88.36 -4.0 58.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.089 -0.505 . . . . 72.22 110.879 -179.803 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -70.89 134.89 85.58 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.645 0.736 . . . . 65.11 110.825 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.85 -6.1 17.85 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.631 2.22 . . . . 74.53 112.362 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 -126.65 33.42 4.97 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.217 -0.447 . . . . 63.52 110.902 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 210' ' ' ALA . . . . . 0.454 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.28 145.77 26.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.148 -0.478 . . . . 62.23 111.063 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -73.31 -25.91 21.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.222 -0.445 . . . . 62.04 111.122 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 212' ' ' MET . . . . . 0.404 ' HG3' ' HA ' ' A' ' 204' ' ' HIS . 0.0 OUTLIER -99.68 8.7 44.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.222 -0.444 . . . . 75.22 110.849 179.908 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 213' ' ' TYR . . . . . 0.449 ' CD1' ' HD2' ' A' ' 214' ' ' PRO . 0.3 OUTLIER -55.31 128.13 66.21 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.679 0.752 . . . . 73.43 110.955 -179.927 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 214' ' ' PRO . . . . . 0.449 ' HD2' ' CD1' ' A' ' 213' ' ' TYR . 54.2 Cg_endo -69.72 -18.54 37.13 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.738 2.292 . . . . 63.01 112.417 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 2.2 p -84.38 48.3 1.48 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.153 -0.476 . . . . 74.24 111.146 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 10.9 t80 . . . . . 0 C--N 1.327 -0.392 0 CA-C-N 116.235 -0.439 . . . . 74.14 110.959 -179.95 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 224' ' ' PHE . . . . . 0.593 ' CD2' HD12 ' A' ' 189' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.888 0.375 . . . . 65.01 110.899 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.64 159.61 42.15 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.182 -0.463 . . . . 64.24 110.919 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 226' ' ' LEU . . . . . 0.63 ' HB3' HD11 ' A' ' 231' ' ' ILE . 24.6 mt -60.21 149.12 34.05 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.287 -0.415 . . . . 53.44 110.882 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 227' ' ' SER . . . . . 0.454 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 1.0 OUTLIER -86.78 152.25 22.67 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.23 -0.441 . . . . 74.21 110.9 -179.927 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -65.19 -68.31 0.37 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.171 -0.468 . . . . 74.54 110.925 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -55.38 -24.97 32.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.174 -0.466 . . . . 72.22 110.826 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 4.9 t0 -69.51 -49.24 56.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.176 -0.465 . . . . 74.23 110.895 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 231' ' ' ILE . . . . . 0.63 HD11 ' HB3' ' A' ' 226' ' ' LEU . 9.2 mt -68.56 -42.63 83.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.203 -0.453 . . . . 73.41 111.211 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 232' ' ' LYS . . . . . 0.41 ' HG3' ' N ' ' A' ' 233' ' ' GLY . 0.2 OUTLIER -59.7 -32.08 70.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.084 -0.507 . . . . 65.42 110.915 179.844 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 233' ' ' GLY . . . . . 0.41 ' N ' ' HG3' ' A' ' 232' ' ' LYS . . . -69.02 -47.11 56.36 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.717 -0.754 . . . . 63.43 112.546 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 13.5 tt -72.59 -30.64 34.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.81 0.338 . . . . 71.54 111.147 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -66.82 -24.56 66.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.108 -0.496 . . . . 70.33 110.975 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 236' ' ' LYS . . . . . 0.472 ' HE3' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.16 -23.1 59.2 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.174 -0.466 . . . . 51.21 110.918 179.929 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 237' ' ' LEU . . . . . 0.683 HD13 ' CD ' ' A' ' 83' ' ' LYS . 10.5 tt -97.24 -38.41 9.69 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.202 -0.454 . . . . 75.41 110.926 179.869 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 238' ' ' TYR . . . . . . . . . . . . . 62.7 m-85 -92.35 -2.66 56.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 51.24 110.914 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.302 0 C-N-CA 120.734 -0.746 . . . . 32.22 112.431 179.946 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 19.0 t-105 . . . . . 0 C--O 1.23 0.057 0 CA-C-O 120.745 0.307 . . . . 71.22 110.958 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 62.5 mt-10 -73.41 -35.47 65.85 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.214 -0.448 . . . . 72.51 110.886 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -63.0 -40.97 99.39 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.139 -0.482 . . . . 61.24 110.939 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.658 ' HB1' ' HE3' ' A' ' 62' ' ' MET . . . -61.78 -41.86 98.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.192 -0.458 . . . . 54.34 111.057 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 39.6 tt0 -66.06 -43.15 88.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 73.12 110.9 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -71.07 -31.48 67.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.173 -0.467 . . . . 72.4 110.893 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -70.22 -35.8 74.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.149 -0.478 . . . . 75.11 110.917 -179.805 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.645 HD13 ' O ' ' A' ' 19' ' ' LEU . 3.2 tm? -67.21 -26.24 66.51 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.162 -0.472 . . . . 72.51 110.921 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.407 ' HG2' ' N ' ' A' ' 21' ' ' ARG . 6.3 ptmt -69.43 -32.64 71.73 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.145 -0.48 . . . . 74.41 110.895 179.837 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.407 ' N ' ' HG2' ' A' ' 20' ' ' LYS . 5.3 ptp180 -86.75 -27.62 23.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.213 -0.449 . . . . 74.05 110.905 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.95 -24.29 64.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.162 -0.472 . . . . 74.31 110.955 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.55 ' O ' ' HB3' ' A' ' 70' ' ' PRO . 19.2 m-85 . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.123 -0.489 . . . . 72.55 110.916 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.436 ' O ' HD13 ' A' ' 39' ' ' LEU . 0.8 OUTLIER . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.76 0.315 . . . . 72.52 110.953 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -64.25 -51.34 64.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.21 -0.45 . . . . 73.13 110.886 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.82 -47.85 81.63 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.101 -0.5 . . . . 63.32 111.064 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 2.4 tttp -60.17 -38.62 83.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.281 -0.418 . . . . 72.32 110.931 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.7 HD21 ' HB2' ' A' ' 54' ' ' LEU . 0.9 OUTLIER -54.6 -36.68 64.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.208 -0.451 . . . . 72.11 110.911 179.902 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.1 ttpp -58.89 -45.72 89.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.183 -0.462 . . . . 62.43 110.914 179.845 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -69.79 -37.34 76.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.22 -0.446 . . . . 75.11 110.908 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.444 ' CE ' HD11 ' A' ' 61' ' ' ILE . 6.7 ttt -68.6 -40.29 80.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.106 -0.497 . . . . 63.43 110.907 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.753 ' HG2' HD11 ' A' ' 48' ' ' LEU . 27.1 mt-30 -65.94 -42.36 90.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.241 -0.436 . . . . 74.45 110.889 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.0 mmpt? -63.37 -28.47 70.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.171 -0.468 . . . . 71.43 110.876 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 15.0 t80 -69.8 -36.84 76.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.218 -0.447 . . . . 73.32 110.915 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.59 ' CZ ' HD12 ' A' ' 61' ' ' ILE . 10.2 m-85 -81.2 -35.24 31.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.165 -0.471 . . . . 70.43 110.907 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 102.79 -6.11 51.6 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.733 -0.746 . . . . 64.34 112.465 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.753 HD11 ' HG2' ' A' ' 43' ' ' GLN . 0.6 OUTLIER -59.71 143.13 87.3 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.593 0.711 . . . . 64.11 110.962 -179.932 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.66 -53.92 0.25 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.712 2.275 . . . . 74.5 112.358 179.894 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.71 HD13 ' OG ' ' A' ' 56' ' ' SER . 0.7 OUTLIER -51.58 108.09 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.146 -0.479 . . . . 71.22 111.157 179.939 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -109.61 160.63 16.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.257 -0.429 . . . . 73.25 111.128 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 57.67 18.51 31.61 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.815 -0.707 . . . . 64.24 112.483 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 10.1 mtt -124.76 161.14 27.07 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.753 0.311 . . . . 75.23 110.885 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.7 ' HB2' HD21 ' A' ' 39' ' ' LEU . 20.1 tp -157.87 96.5 1.49 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.186 -0.461 . . . . 73.4 110.855 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.414 ' HA ' HG13 ' A' ' 59' ' ' ILE . 0.7 OUTLIER 174.77 -29.06 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.192 -0.458 . . . . 44.35 110.87 179.892 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 56' ' ' SER . . . . . 0.71 ' OG ' HD13 ' A' ' 50' ' ' ILE . 2.5 p -85.08 -99.63 0.06 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.155 -0.475 . . . . 75.25 110.876 -179.83 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -84.84 -30.5 24.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.139 -0.482 . . . . 61.22 110.866 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.44 HG23 HD12 ' A' ' 50' ' ' ILE . 41.9 t -59.33 -43.75 90.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.193 -0.458 . . . . 70.12 111.144 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.414 HG13 ' HA ' ' A' ' 55' ' ' ASN . 2.9 mm -75.05 -31.33 24.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.172 -0.467 . . . . 74.43 111.1 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -66.1 -44.21 85.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.165 -0.471 . . . . 73.45 110.869 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.59 HD12 ' CZ ' ' A' ' 46' ' ' PHE . 35.5 pt -66.29 -29.78 47.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.115 -0.493 . . . . 74.52 111.143 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' MET . . . . . 0.658 ' HE3' ' HB1' ' A' ' 15' ' ' ALA . 1.4 mmm -71.18 -33.2 69.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.166 -0.47 . . . . 74.01 110.885 179.836 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -88.09 -25.66 22.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.199 -0.455 . . . . 42.22 110.896 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.01 137.69 37.47 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.573 0.702 . . . . 65.34 110.897 179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -69.79 113.2 3.3 Favored 'Trans proline' 0 C--O 1.232 0.217 0 C-N-CA 122.66 2.24 . . . . 72.11 112.349 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 4.6 ttm180 -106.87 -85.75 0.5 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.296 -0.411 . . . . 71.51 110.873 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -145.86 156.31 43.47 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.19 -0.459 . . . . 55.3 110.848 -179.929 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.562 ' HA2' HG23 ' A' ' 155' ' ' THR . . . -96.63 16.78 60.43 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.739 -0.743 . . . . 64.23 112.468 -179.924 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.453 HG21 ' CD2' ' A' ' 198' ' ' HIS . 0.0 OUTLIER -111.85 133.15 21.66 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.604 0.716 . . . . 74.23 111.091 -179.927 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 70' ' ' PRO . . . . . 0.55 ' HB3' ' O ' ' A' ' 23' ' ' TYR . 54.1 Cg_endo -69.7 165.73 29.92 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.66 2.24 . . . . 63.44 112.367 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -120.52 38.51 3.98 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.234 -0.439 . . . . 74.45 110.859 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.167 -0.47 . . . . 53.43 111.102 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo . . . . . 0 C--O 1.232 0.191 0 CA-C-O 120.859 0.275 . . . . 71.11 112.332 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.971 ' HD2' HD23 ' A' ' 237' ' ' LEU . 0.3 OUTLIER -89.61 165.34 14.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.237 -0.438 . . . . 64.45 110.855 179.929 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 84' ' ' TRP . . . . . 0.493 ' CD1' ' HA ' ' A' ' 200' ' ' LEU . 24.5 m95 -55.86 123.57 14.69 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.153 -0.476 . . . . 73.31 110.91 179.868 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -115.16 1.35 13.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.243 -0.435 . . . . 65.3 111.109 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -69.63 163.25 25.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.198 -0.455 . . . . 70.34 110.849 -179.874 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.92 -7.21 57.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.153 -0.476 . . . . 71.12 110.837 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -172.76 139.21 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.231 -0.441 . . . . 74.14 111.197 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 13.3 t -122.51 129.59 75.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 72.25 111.091 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.725 HG22 ' HB3' ' A' ' 125' ' ' ARG . 5.0 p -116.99 168.22 10.44 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.169 -0.468 . . . . 71.01 111.144 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.413 ' CD1' ' N ' ' A' ' 91' ' ' TYR . 2.5 p90 -145.26 146.56 31.72 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.259 -0.428 . . . . 70.51 110.909 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.416 ' O ' ' HA ' ' A' ' 135' ' ' MET . 3.4 ttt180 -147.04 132.09 18.23 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.148 -0.478 . . . . 71.25 110.831 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 3.9 mp -74.67 134.97 28.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.155 -0.475 . . . . 72.4 111.113 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.556 HG22 ' CE ' ' A' ' 135' ' ' MET . 11.2 t -93.96 -40.63 11.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.198 -0.456 . . . . 60.2 111.163 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 1.4 t -139.45 164.03 30.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.136 -0.484 . . . . 64.24 110.881 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 11.2 p90 -113.54 152.52 30.12 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.115 -0.493 . . . . 72.25 110.911 -179.859 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.471 ' OG1' HG21 ' A' ' 105' ' ' VAL . 0.2 OUTLIER -82.74 141.02 32.7 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.126 -0.488 . . . . 64.11 111.119 -179.931 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 4.4 ppt_? -74.15 -7.08 51.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.243 -0.435 . . . . 72.14 110.868 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -96.4 -26.47 15.32 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.181 -0.463 . . . . 74.13 110.82 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.567 HD21 ' HA ' ' A' ' 179' ' ' THR . 0.6 OUTLIER -133.84 153.68 80.06 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-O 121.543 0.687 . . . . 72.52 110.954 -179.928 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 101' ' ' PRO . . . . . 0.585 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.9 Cg_endo -69.76 150.89 68.82 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.696 2.264 . . . . 73.11 112.322 179.82 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 16.0 t-160 -52.22 -26.21 11.14 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.138 -0.483 . . . . 74.11 110.825 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.585 HG22 ' HB2' ' A' ' 101' ' ' PRO . 13.9 tt -76.8 -39.2 30.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.199 -0.455 . . . . 74.02 111.122 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 104' ' ' THR . . . . . 0.67 ' O ' HD22 ' A' ' 108' ' ' LEU . 3.4 m -69.46 -38.56 77.81 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.141 -0.481 . . . . 52.11 111.141 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.744 ' O ' HG13 ' A' ' 109' ' ' VAL . 98.7 t -72.7 -45.08 58.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.275 -0.421 . . . . 71.51 111.152 179.88 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.645 ' O ' HG22 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -64.72 -42.42 95.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.21 -0.45 . . . . 63.44 110.823 179.931 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 13.8 ptm180 -70.14 -34.06 72.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.179 -0.464 . . . . 75.02 110.835 -179.842 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.67 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -61.0 -48.84 79.95 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.221 -0.445 . . . . 71.04 110.961 179.95 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.744 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.4 m -55.78 -41.66 66.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.204 -0.453 . . . . 72.31 111.082 179.867 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.471 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 13.5 t -70.1 -34.29 72.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.19 -0.459 . . . . 72.14 110.845 -179.841 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.463 ' CG ' HD21 ' A' ' 189' ' ' LEU . 0.5 OUTLIER -62.44 -33.53 75.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.164 -0.471 . . . . 74.35 110.928 179.912 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -94.68 -40.2 9.93 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.165 -0.47 . . . . 74.32 111.068 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.714 ' CD1' HD12 ' A' ' 196' ' ' LEU . 0.4 OUTLIER -64.86 -33.11 75.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.224 -0.444 . . . . 72.0 110.926 -179.974 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -65.68 -36.4 83.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.164 -0.471 . . . . 72.34 110.887 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 115' ' ' MET . . . . . 0.746 ' O ' HD11 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -64.58 -34.48 78.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.174 -0.466 . . . . 54.12 110.892 179.932 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 116' ' ' TRP . . . . . 0.622 ' O ' ' HG3' ' A' ' 119' ' ' GLU . 6.9 m95 -64.24 -49.48 71.77 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.199 -0.455 . . . . 75.23 110.946 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 117' ' ' GLY . . . . . 0.567 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -74.79 -19.41 79.92 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.802 -0.713 . . . . 73.32 112.45 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 5.6 mtmt -70.53 -14.01 62.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.739 0.304 . . . . 72.42 110.933 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.638 ' OE1' HG23 ' A' ' 120' ' ' ILE . 2.3 pp20? -109.97 12.45 23.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.243 -0.435 . . . . 75.24 110.877 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 1.082 HD12 HD12 ' A' ' 122' ' ' LEU . 4.7 pt -144.25 142.98 20.69 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.64 0.733 . . . . 71.34 111.133 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 16.57 0.21 Allowed 'Trans proline' 0 C--O 1.233 0.268 0 C-N-CA 122.723 2.282 . . . . 72.21 112.33 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 1.082 HD12 HD12 ' A' ' 120' ' ' ILE . 5.2 mt -62.54 -158.07 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.301 -0.409 . . . . 73.22 110.908 -179.981 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 4.5 t-80 -156.47 121.06 4.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.196 -0.456 . . . . 74.12 110.886 179.796 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 11.6 m-30 -109.88 148.69 31.09 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.205 -0.452 . . . . 75.54 110.905 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.725 ' HB3' HG22 ' A' ' 90' ' ' THR . 0.0 OUTLIER -132.03 142.16 49.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.105 -0.498 . . . . 75.14 110.852 -179.878 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 126' ' ' LYS . . . . . 0.457 ' HE3' HG13 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -80.03 149.35 30.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.187 -0.46 . . . . 72.22 110.957 179.909 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 127' ' ' VAL . . . . . 1.025 HG11 ' HB2' ' A' ' 132' ' ' ALA . 26.5 m -103.13 126.14 57.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.195 -0.457 . . . . 50.13 111.087 179.93 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.608 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -142.98 -9.81 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.204 -0.453 . . . . 74.43 111.157 179.885 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 129' ' ' TRP . . . . . 0.608 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -157.31 108.97 2.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.164 -0.471 . . . . 71.25 110.936 179.96 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 109.1 -159.7 13.93 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.727 -0.749 . . . . 62.11 112.512 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 23.7 p -101.96 156.11 17.74 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.821 0.343 . . . . 63.25 111.153 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 132' ' ' ALA . . . . . 1.025 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -111.97 165.32 12.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.26 -0.427 . . . . 51.34 111.06 179.873 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 133' ' ' ASP . . . . . 0.466 ' HB2' HD12 ' A' ' 134' ' ' ILE . 3.0 m-20 -70.03 -65.37 0.73 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.137 -0.483 . . . . 75.41 110.877 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 134' ' ' ILE . . . . . 0.491 HD12 ' N ' ' A' ' 134' ' ' ILE . 3.9 mp -88.71 106.74 17.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.218 -0.446 . . . . 70.51 111.145 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 135' ' ' MET . . . . . 0.556 ' CE ' HG22 ' A' ' 94' ' ' VAL . 0.9 OUTLIER -91.49 128.36 37.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.219 -0.446 . . . . 72.43 110.897 179.838 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.458 ' CD1' HG22 ' A' ' 134' ' ' ILE . 0.5 OUTLIER -106.01 97.6 5.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.302 -0.408 . . . . 70.04 111.1 -179.986 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 137' ' ' GLY . . . . . 0.4 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -130.18 157.73 22.09 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.727 -0.749 . . . . 63.34 112.479 179.932 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 138' ' ' PHE . . . . . 0.616 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 2.7 m-85 -105.12 147.5 27.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.88 0.371 . . . . 74.01 110.89 -179.844 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.616 ' HB2' ' O ' ' A' ' 138' ' ' PHE . . . 166.81 166.56 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.196 -0.456 . . . . 71.21 111.102 179.923 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 47.4 mtm180 -104.74 173.06 6.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.205 -0.452 . . . . 62.21 110.867 -179.908 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -55.02 -20.73 21.4 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.793 -0.718 . . . . 74.24 112.46 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -65.42 -13.57 59.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.818 0.342 . . . . 75.03 111.136 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 2.0 p80 -68.65 -11.13 59.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 71.11 110.917 179.916 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 116.06 39.41 0.88 Allowed Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.752 -0.737 . . . . 45.51 112.468 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -117.91 142.84 46.89 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.755 0.312 . . . . 72.14 110.838 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 52.8 p -65.28 153.73 40.24 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 51.25 110.883 -179.759 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 64.88 134.61 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.674 0.75 . . . . 73.4 110.912 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.67 134.62 28.61 Favored 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.7 2.267 . . . . 74.53 112.362 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -69.21 -32.22 71.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.288 -0.414 . . . . 63.52 110.862 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 74.23 -1.45 3.07 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.119 -0.491 . . . . 63.11 110.835 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 51.04 -111.12 1.16 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.737 -0.744 . . . . 71.41 112.474 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.8 139.96 41.36 Favored 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.641 2.227 . . . . 75.11 112.378 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 103.5 -154.38 17.96 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.744 -0.741 . . . . 70.32 112.445 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -41.41 153.17 0.05 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.875 0.369 . . . . 73.25 110.864 -179.864 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 155' ' ' THR . . . . . 0.562 HG23 ' HA2' ' A' ' 68' ' ' GLY . 0.2 OUTLIER 77.31 108.07 0.08 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.236 -0.438 . . . . 44.41 111.136 -179.993 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 156' ' ' LEU . . . . . 1.014 HD21 HG21 ' A' ' 186' ' ' ILE . 0.5 OUTLIER -90.83 -53.49 4.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 75.02 110.93 179.953 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 157' ' ' ALA . . . . . 0.544 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -165.44 148.14 7.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.133 -0.485 . . . . 71.42 111.067 179.809 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 20.0 p-80 -105.75 123.8 48.53 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.156 -0.475 . . . . 72.02 110.903 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -111.33 154.04 25.13 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.274 -0.421 . . . . 74.42 111.094 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 17.7 m-85 -106.8 146.99 30.22 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.202 -0.454 . . . . 75.31 110.845 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 161' ' ' ALA . . . . . 0.707 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -78.47 164.51 55.67 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 121.631 0.729 . . . . 61.04 111.015 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 162' ' ' PRO . . . . . 0.707 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.3 Cg_endo -69.77 78.12 1.03 Allowed 'Trans proline' 0 C--N 1.343 0.237 0 C-N-CA 122.734 2.29 . . . . 74.44 112.299 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -137.81 114.62 1.11 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.692 -0.766 . . . . 61.41 112.447 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 66.64 168.39 0.23 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.864 0.364 . . . . 73.1 111.143 -179.875 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -64.64 -48.17 75.69 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.695 -0.764 . . . . 74.03 112.474 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 166' ' ' LEU . . . . . 0.461 ' C ' HD23 ' A' ' 166' ' ' LEU . 10.1 tt -62.7 -40.01 95.81 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.846 0.355 . . . . 65.12 110.916 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -79.35 163.16 48.45 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.739 -0.743 . . . . 43.43 112.454 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 89.88 22.72 35.12 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.686 -0.769 . . . . 74.31 112.457 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -91.98 161.65 14.71 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.769 0.319 . . . . 63.41 110.888 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.38 130.46 55.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.231 -0.441 . . . . 74.21 111.076 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 4.8 m170 -126.61 158.46 36.24 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.198 -0.455 . . . . 72.53 110.826 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 58.8 m-85 -140.93 138.84 34.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.151 -0.477 . . . . 71.44 110.868 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 66.7 t0 -70.39 96.77 1.18 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.155 -0.475 . . . . 74.11 110.884 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 2.2 pp20? -57.87 -16.62 12.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.174 -0.467 . . . . 72.25 110.878 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -79.43 -16.4 56.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.145 -0.48 . . . . 73.32 110.814 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 25.1 mm-40 -79.78 -174.91 4.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.262 -0.426 . . . . 63.2 110.839 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 39.6 mtm180 -111.23 111.17 22.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.128 -0.487 . . . . 63.14 110.874 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 12.5 m95 -117.13 145.03 44.06 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.253 -0.43 . . . . 72.31 110.953 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 179' ' ' THR . . . . . 0.57 HG21 ' HB3' ' A' ' 182' ' ' SER . 7.2 t -178.58 163.79 1.55 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.265 -0.425 . . . . 74.13 111.079 -179.914 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -123.09 -68.21 0.9 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 45.33 110.902 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -66.99 -10.83 57.23 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.761 -0.733 . . . . 62.41 112.479 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 182' ' ' SER . . . . . 0.57 ' HB3' HG21 ' A' ' 179' ' ' THR . 0.3 OUTLIER -97.36 -24.44 15.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.763 0.316 . . . . 64.5 110.802 -179.71 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 183' ' ' SER . . . . . 0.449 ' C ' ' O ' ' A' ' 182' ' ' SER . 1.3 m 32.93 61.69 0.38 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.178 -0.465 . . . . 64.12 110.826 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -116.82 -33.66 4.72 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.196 -0.456 . . . . 74.2 110.928 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -121.66 -135.38 4.74 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.743 -0.742 . . . . 73.01 112.486 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 186' ' ' ILE . . . . . 1.014 HG21 HD21 ' A' ' 156' ' ' LEU . 8.5 mm -79.41 97.58 2.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.784 0.326 . . . . 73.22 111.113 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -50.87 123.46 9.18 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.193 -0.458 . . . . 71.31 110.846 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 188' ' ' PHE . . . . . 0.731 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.5 t80 -54.27 -36.55 63.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.144 -0.48 . . . . 75.45 110.821 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 189' ' ' LEU . . . . . 0.481 HD12 ' CE2' ' A' ' 224' ' ' PHE . 0.0 OUTLIER -67.43 -47.55 69.88 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.189 -0.459 . . . . 52.02 110.922 -179.958 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 40.4 t80 -69.37 -39.28 78.15 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.222 -0.445 . . . . 74.22 110.874 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 191' ' ' ALA . . . . . 0.725 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -71.64 -35.49 70.42 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.122 -0.49 . . . . 50.03 111.091 179.858 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 192' ' ' ALA . . . . . 0.668 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -56.48 -44.91 81.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.214 -0.448 . . . . 52.11 111.103 179.905 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.4 -41.75 90.18 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.2 -0.455 . . . . 72.43 111.193 -179.88 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 18.1 t-160 -72.7 -39.7 66.78 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.195 -0.457 . . . . 71.44 110.843 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -75.02 -48.1 25.77 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.215 -0.448 . . . . 71.01 111.077 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 196' ' ' LEU . . . . . 0.714 HD12 ' CD1' ' A' ' 113' ' ' LEU . 4.5 mm? -62.22 -39.04 91.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.199 -0.455 . . . . 74.51 110.885 -179.892 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -61.24 -26.54 66.18 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.736 -0.745 . . . . 52.23 112.485 179.916 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 198' ' ' HIS . . . . . 0.453 ' CD2' HG21 ' A' ' 69' ' ' VAL . 6.9 m-70 -70.06 -32.21 70.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.831 0.348 . . . . 75.21 110.856 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -71.72 -21.25 61.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.199 -0.455 . . . . 71.13 110.823 -179.754 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 200' ' ' LEU . . . . . 0.493 ' HA ' ' CD1' ' A' ' 84' ' ' TRP . 0.3 OUTLIER -93.08 -2.44 55.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.154 -0.475 . . . . 64.13 110.974 179.988 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 90.55 -9.5 77.41 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.731 -0.747 . . . . 50.41 112.509 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 202' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.91 129.41 26.8 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.82 0.343 . . . . 63.21 110.858 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -101.02 159.37 18.9 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.734 -0.746 . . . . 64.44 112.451 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 17.5 m-70 -55.93 167.38 0.6 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.774 0.321 . . . . 74.32 110.914 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -129.32 154.14 47.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.242 -0.435 . . . . 53.34 110.873 -179.731 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -87.55 -4.64 58.97 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.178 -0.464 . . . . 72.22 110.821 -179.794 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.72 136.99 82.86 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-O 121.614 0.721 . . . . 65.11 110.927 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 -6.33 18.34 Favored 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.688 2.259 . . . . 74.53 112.375 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -128.05 30.11 5.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.23 -0.441 . . . . 63.52 110.887 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 210' ' ' ALA . . . . . 0.444 ' HA ' ' HB2' ' A' ' 227' ' ' SER . . . -87.17 145.44 26.42 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.204 -0.453 . . . . 62.23 111.122 179.84 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -68.22 -28.53 41.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.256 -0.429 . . . . 62.04 111.167 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 11.0 mtp -97.91 10.52 40.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.134 -0.484 . . . . 75.22 110.897 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 213' ' ' TYR . . . . . 0.412 ' HA ' ' HD2' ' A' ' 214' ' ' PRO . 1.9 t80 -55.56 114.35 7.17 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.638 0.732 . . . . 73.43 110.926 -179.891 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 214' ' ' PRO . . . . . 0.412 ' HD2' ' HA ' ' A' ' 213' ' ' TYR . 53.5 Cg_endo -69.78 -18.36 36.96 Favored 'Trans proline' 0 C--O 1.232 0.209 0 C-N-CA 122.687 2.258 . . . . 63.01 112.316 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 215' ' ' THR . . . . . 0.551 HG23 ' CG2' ' A' ' 61' ' ' ILE . 0.2 OUTLIER -84.24 52.29 2.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.23 -0.441 . . . . 74.24 111.068 -179.893 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 5.8 t80 . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 116.26 -0.427 . . . . 74.14 110.906 -179.972 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 224' ' ' PHE . . . . . 0.481 ' CE2' HD12 ' A' ' 189' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.956 0.408 . . . . 65.01 110.843 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -143.4 171.66 13.83 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.21 -0.45 . . . . 64.24 110.905 179.901 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 226' ' ' LEU . . . . . 0.746 HD11 ' O ' ' A' ' 115' ' ' MET . 25.5 mt -74.39 148.3 41.34 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.242 -0.435 . . . . 53.44 110.933 179.93 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 227' ' ' SER . . . . . 0.444 ' HB2' ' HA ' ' A' ' 210' ' ' ALA . 1.3 t -87.47 152.78 21.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.456 . . . . 74.21 110.873 -179.953 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 55.8 mt-30 -65.7 -64.77 0.78 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.137 -0.483 . . . . 74.54 110.928 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -55.85 -26.85 48.8 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 72.22 110.827 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -69.08 -50.06 51.69 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.192 -0.458 . . . . 74.23 110.901 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 231' ' ' ILE . . . . . 0.744 HD11 HD22 ' A' ' 226' ' ' LEU . 2.6 mm -69.93 -43.96 79.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.226 -0.443 . . . . 73.41 111.139 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 3.4 pttt -56.93 -32.69 66.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.168 -0.469 . . . . 65.42 110.847 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 233' ' ' GLY . . . . . 0.441 ' O ' ' HG3' ' A' ' 236' ' ' LYS . . . -65.52 -49.41 60.57 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.723 -0.751 . . . . 63.43 112.484 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 20.5 tt -73.77 -29.95 27.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.712 0.291 . . . . 71.54 111.075 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -62.3 -40.52 96.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.284 -0.417 . . . . 70.33 110.823 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 236' ' ' LYS . . . . . 0.444 ' HE2' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.24 -15.25 61.0 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.252 -0.431 . . . . 51.21 110.895 -179.99 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 237' ' ' LEU . . . . . 0.971 HD23 ' HD2' ' A' ' 83' ' ' LYS . 1.0 OUTLIER -96.57 -35.63 11.02 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.187 -0.46 . . . . 75.41 110.887 179.925 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 238' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -92.41 -35.58 13.6 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.221 -0.445 . . . . 51.24 110.911 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.32 0 C-N-CA 120.715 -0.755 . . . . 32.22 112.466 179.992 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.547 ' CH2' HD23 ' A' ' 54' ' ' LEU . 15.3 t-105 . . . . . 0 C--O 1.23 0.07 0 CA-C-O 120.672 0.273 . . . . 71.22 110.846 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -68.68 -35.46 77.24 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.282 -0.417 . . . . 72.51 110.939 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -62.94 -37.47 87.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.147 -0.479 . . . . 61.24 110.917 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.401 ' O ' ' HE3' ' A' ' 62' ' ' MET . . . -57.25 -40.15 77.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.209 -0.451 . . . . 54.34 111.087 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.561 ' OE1' HD12 ' A' ' 35' ' ' LEU . 1.6 tt0 -70.98 -42.89 69.09 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 73.12 110.955 -179.91 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -67.44 -31.61 71.9 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.182 -0.463 . . . . 72.4 110.865 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 7.4 m-85 -66.53 -41.75 88.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.224 -0.444 . . . . 75.11 110.858 -179.804 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.703 HD13 ' O ' ' A' ' 19' ' ' LEU . 2.1 tm? -71.36 -29.92 65.54 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.106 -0.497 . . . . 72.51 110.908 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.435 ' HE2' ' HA ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -61.44 -39.76 91.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.179 -0.464 . . . . 74.41 110.88 179.85 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.435 ' HA ' ' HE2' ' A' ' 20' ' ' LYS . 6.0 ptp180 -82.56 -27.72 31.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.226 -0.443 . . . . 74.05 110.911 179.957 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.0 m-30 -60.27 -15.87 28.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.189 -0.46 . . . . 74.31 110.897 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.626 ' HB3' HG21 ' A' ' 72' ' ' VAL . 8.4 m-85 . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.176 -0.465 . . . . 72.55 110.925 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.561 HD12 ' OE1' ' A' ' 16' ' ' GLN . 1.4 tt . . . . . 0 N--CA 1.458 -0.048 0 CA-C-O 120.783 0.325 . . . . 72.52 110.906 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.29 -51.41 63.65 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 73.13 110.817 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -55.3 -42.66 73.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.21 -0.45 . . . . 63.32 111.121 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.475 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.8 OUTLIER -70.38 -48.47 56.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.242 -0.436 . . . . 72.32 110.888 179.937 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.451 HD13 ' HG ' ' A' ' 35' ' ' LEU . 4.3 mp -54.41 -37.29 64.91 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.258 -0.428 . . . . 72.11 110.945 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.6 tmmt? -58.63 -45.55 89.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.181 -0.463 . . . . 62.43 110.898 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.475 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 3.0 pt-20 -60.68 -32.79 71.98 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.225 -0.443 . . . . 75.11 110.849 -179.965 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 9.3 ttt -68.47 -33.72 74.67 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.143 -0.48 . . . . 63.43 110.909 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.66 ' CD ' HD11 ' A' ' 48' ' ' LEU . 2.2 mm100 -61.63 -39.71 92.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.219 -0.446 . . . . 74.45 110.833 -179.888 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.2 mmpt? -71.6 -33.77 69.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.235 -0.439 . . . . 71.43 110.861 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 33.6 t80 -70.77 -40.26 72.75 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.231 -0.441 . . . . 73.32 110.94 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.861 ' CZ ' HD13 ' A' ' 61' ' ' ILE . 2.8 m-85 -81.76 -35.16 29.93 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.09 -0.505 . . . . 70.43 110.838 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 104.62 -10.08 49.05 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.719 -0.753 . . . . 64.34 112.469 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.686 HD23 ' HB3' ' A' ' 46' ' ' PHE . 0.8 OUTLIER -62.37 134.54 94.9 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.661 0.743 . . . . 64.11 110.897 -179.902 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.462 ' O ' HG23 ' A' ' 51' ' ' THR . 53.6 Cg_endo -69.76 -51.43 0.39 Allowed 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.627 2.218 . . . . 74.5 112.374 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.65 HD11 ' HG2' ' A' ' 57' ' ' ARG . 0.8 OUTLIER -49.61 108.44 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.263 -0.426 . . . . 71.22 111.189 179.895 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.462 HG23 ' O ' ' A' ' 49' ' ' PRO . 77.8 p -97.68 154.1 17.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.183 -0.462 . . . . 73.25 111.133 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 57.81 19.32 35.82 Favored Glycine 0 N--CA 1.453 -0.216 0 C-N-CA 120.724 -0.75 . . . . 64.24 112.445 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 12.8 mmt -101.43 161.12 13.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.811 0.338 . . . . 75.23 110.906 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.547 HD23 ' CH2' ' A' ' 12' ' ' TRP . 28.3 tp -172.21 84.66 0.07 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.215 -0.448 . . . . 73.4 110.884 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.3 t30 175.46 -28.86 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.134 -0.484 . . . . 44.35 110.88 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 30.9 t -89.42 -103.19 0.09 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.132 -0.486 . . . . 75.25 110.88 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.65 ' HG2' HD11 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -84.84 -25.12 28.28 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.182 -0.463 . . . . 61.22 110.956 179.99 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.474 HG22 HD13 ' A' ' 48' ' ' LEU . 46.1 t -64.05 -42.15 94.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.166 -0.47 . . . . 70.12 111.141 179.972 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.9 mm -75.27 -31.66 24.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.162 -0.472 . . . . 74.43 111.117 179.921 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -59.69 -44.08 93.79 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.174 -0.466 . . . . 73.45 110.9 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.861 HD13 ' CZ ' ' A' ' 46' ' ' PHE . 1.4 pp -63.05 -29.48 47.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.142 -0.481 . . . . 74.52 111.164 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' MET . . . . . 0.401 ' HE3' ' O ' ' A' ' 15' ' ' ALA . 11.7 mmt -65.08 -36.73 85.24 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.207 -0.451 . . . . 74.01 110.808 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 15.8 pt20 -91.2 -26.25 19.14 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.306 -0.407 . . . . 42.22 110.877 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.16 125.4 70.3 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.548 0.69 . . . . 65.34 110.911 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.64 151.77 69.82 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.677 2.251 . . . . 72.11 112.351 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.14 -74.55 0.17 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.196 -0.457 . . . . 71.51 110.883 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 26.7 t -130.16 141.56 50.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.217 -0.447 . . . . 55.3 110.935 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.595 ' HA2' HG23 ' A' ' 155' ' ' THR . . . -95.16 16.36 61.47 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.794 -0.717 . . . . 64.23 112.467 -179.909 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.641 HG22 ' HD2' ' A' ' 70' ' ' PRO . 0.7 OUTLIER -125.63 145.4 51.26 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.57 0.7 . . . . 74.23 111.094 -179.927 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 70' ' ' PRO . . . . . 0.641 ' HD2' HG22 ' A' ' 69' ' ' VAL . 53.6 Cg_endo -69.8 -179.85 3.22 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.727 2.285 . . . . 63.44 112.353 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -133.89 22.11 3.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.251 -0.431 . . . . 74.45 110.899 179.904 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.626 HG21 ' HB3' ' A' ' 23' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.258 -0.428 . . . . 53.43 111.123 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo . . . . . 0 N--CA 1.465 -0.183 0 CA-C-O 120.867 0.278 . . . . 71.11 112.369 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.829 ' HD2' HD23 ' A' ' 237' ' ' LEU . 0.1 OUTLIER -88.83 150.48 22.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.189 -0.46 . . . . 64.45 110.883 179.925 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 84' ' ' TRP . . . . . 0.41 ' CD1' ' HA ' ' A' ' 200' ' ' LEU . 70.7 m95 -45.69 109.81 0.21 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.194 -0.457 . . . . 73.31 110.953 179.892 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 15.0 t -95.06 -6.65 41.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.261 -0.427 . . . . 65.3 111.17 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.1 m -65.67 177.94 1.13 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.257 -0.429 . . . . 70.34 110.856 -179.786 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 8.8 mmtp -96.26 -12.0 25.17 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.129 -0.487 . . . . 71.12 110.872 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -156.79 142.64 9.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.261 -0.427 . . . . 74.14 111.093 179.924 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 89.9 t -115.69 130.37 70.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.187 -0.461 . . . . 72.25 111.131 179.864 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.412 HG22 HG13 ' A' ' 127' ' ' VAL . 0.0 OUTLIER -115.7 146.83 41.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.193 -0.458 . . . . 71.01 111.212 179.962 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 4.9 p90 -141.54 146.79 36.78 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.289 -0.414 . . . . 70.51 110.974 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 6.2 ttt180 -150.69 139.0 20.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.155 -0.475 . . . . 71.25 110.862 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.422 HD11 ' HA ' ' A' ' 106' ' ' ASP . 14.2 mm -75.13 125.35 34.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.212 -0.449 . . . . 72.4 111.116 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.657 HG22 ' SD ' ' A' ' 135' ' ' MET . 5.7 t -83.0 -40.58 16.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.139 -0.482 . . . . 60.2 111.175 179.881 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -151.0 169.41 21.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.141 -0.482 . . . . 64.24 110.845 -179.882 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 11.1 p90 -129.72 153.2 48.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.125 -0.489 . . . . 72.25 110.902 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.9 t -101.55 141.68 34.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.121 -0.49 . . . . 64.11 111.122 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.66 -17.78 1.47 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.173 -0.467 . . . . 72.14 110.894 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -65.09 -35.47 81.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.185 -0.462 . . . . 74.13 110.813 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.712 HD21 ' HA ' ' A' ' 179' ' ' THR . 1.8 mp -144.71 152.21 51.93 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 121.616 0.722 . . . . 72.52 110.907 -179.962 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 101' ' ' PRO . . . . . 0.568 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.3 Cg_endo -69.78 151.11 68.88 Favored 'Trans proline' 0 C--O 1.231 0.143 0 C-N-CA 122.762 2.308 . . . . 73.11 112.321 179.845 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 3.3 t-160 -52.68 -26.71 14.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.222 -0.444 . . . . 74.11 110.815 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.568 HG22 ' HB2' ' A' ' 101' ' ' PRO . 2.5 tp -76.64 -39.53 32.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.276 -0.42 . . . . 74.02 111.106 -179.939 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 104' ' ' THR . . . . . 0.684 ' O ' HD22 ' A' ' 108' ' ' LEU . 3.3 m -69.24 -39.9 78.2 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.152 -0.476 . . . . 52.11 111.215 179.913 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.768 ' O ' HG13 ' A' ' 109' ' ' VAL . 70.6 t -72.62 -45.87 56.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.165 -0.47 . . . . 71.51 111.098 179.926 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.627 ' O ' HG22 ' A' ' 109' ' ' VAL . 59.7 t0 -58.56 -44.98 89.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.453 . . . . 63.44 110.844 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 14.4 ptm180 -70.2 -34.02 72.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.217 -0.447 . . . . 75.02 110.862 -179.816 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.684 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -61.21 -49.56 76.65 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.133 -0.485 . . . . 71.04 110.901 -179.93 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.768 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.4 m -55.99 -41.99 70.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.144 -0.48 . . . . 72.31 111.142 179.841 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.468 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 37.5 t -70.12 -34.16 72.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.19 -0.459 . . . . 72.14 110.869 -179.865 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.469 ' CG ' HD21 ' A' ' 189' ' ' LEU . 0.3 OUTLIER -62.29 -32.86 73.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.12 -0.491 . . . . 74.35 110.923 179.955 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -95.63 -40.98 9.14 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.232 -0.44 . . . . 74.32 111.06 179.828 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.813 ' CD1' HD12 ' A' ' 196' ' ' LEU . 0.5 OUTLIER -65.86 -33.15 75.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.278 -0.419 . . . . 72.0 110.856 -179.922 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 39.8 t30 -69.61 -39.14 77.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 72.34 110.844 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 115' ' ' MET . . . . . 0.511 ' O ' HD11 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -62.58 -34.78 77.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.165 -0.471 . . . . 54.12 110.964 179.868 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 7.0 m95 -62.41 -51.85 65.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.152 -0.476 . . . . 75.23 110.946 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 117' ' ' GLY . . . . . 0.558 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -73.42 -24.06 75.87 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.726 -0.75 . . . . 73.32 112.478 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 24.9 mtmt -67.75 -13.93 62.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.726 0.298 . . . . 72.42 110.883 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.465 ' HG2' HG13 ' A' ' 231' ' ' ILE . 0.4 OUTLIER -107.51 13.93 26.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.278 -0.419 . . . . 75.24 110.824 -179.996 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 0.98 HD12 HD12 ' A' ' 122' ' ' LEU . 7.5 pt -144.61 155.96 56.57 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.642 0.734 . . . . 71.34 111.141 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.79 4.68 2.06 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.681 2.254 . . . . 72.21 112.344 179.887 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.98 HD12 HD12 ' A' ' 120' ' ' ILE . 4.9 mt -61.99 -156.36 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 73.22 110.88 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 28.6 t-80 -163.12 138.06 6.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.227 -0.442 . . . . 74.12 110.868 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 124' ' ' PHE . . . . . 0.55 ' CD2' HD21 ' A' ' 113' ' ' LEU . 30.6 m-85 -123.35 141.77 51.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.165 -0.471 . . . . 75.54 110.864 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -121.55 141.54 50.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.141 -0.481 . . . . 75.14 110.838 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 126' ' ' LYS . . . . . 0.587 ' HE3' HG13 ' A' ' 128' ' ' VAL . 0.1 OUTLIER -80.78 146.48 30.95 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.18 -0.464 . . . . 72.22 110.913 179.94 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 127' ' ' VAL . . . . . 1.014 HG11 ' HB2' ' A' ' 132' ' ' ALA . 29.6 m -103.12 126.26 57.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.243 -0.435 . . . . 50.13 111.13 179.868 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.587 HG13 ' HE3' ' A' ' 126' ' ' LYS . 0.0 OUTLIER -141.55 -16.8 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.193 -0.458 . . . . 74.43 111.111 179.925 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 129' ' ' TRP . . . . . 0.531 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -147.21 109.1 4.41 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.199 -0.455 . . . . 71.25 110.949 179.955 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.69 -161.46 13.57 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.734 -0.746 . . . . 62.11 112.461 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.85 156.65 17.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.752 0.311 . . . . 63.25 111.176 -179.883 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 132' ' ' ALA . . . . . 1.014 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -111.22 164.62 12.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.213 -0.449 . . . . 51.34 111.089 179.88 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.53 -57.75 5.32 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.235 -0.439 . . . . 75.41 110.878 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 20.8 mt -82.57 132.86 30.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.222 -0.444 . . . . 70.51 111.138 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 135' ' ' MET . . . . . 0.657 ' SD ' HG22 ' A' ' 94' ' ' VAL . 27.7 mmt -109.31 115.65 30.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.161 -0.472 . . . . 72.43 110.893 179.879 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -106.07 90.51 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.237 -0.438 . . . . 70.04 111.086 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 137' ' ' GLY . . . . . 0.468 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -129.84 167.96 21.43 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.735 -0.745 . . . . 63.34 112.45 179.905 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 138' ' ' PHE . . . . . 0.461 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 2.0 m-85 -105.39 149.62 25.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.869 0.366 . . . . 74.01 110.898 -179.843 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.614 ' HB1' ' CB ' ' A' ' 143' ' ' HIS . . . 175.84 167.23 0.39 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.129 -0.487 . . . . 71.21 111.104 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 72.8 mtt180 -104.14 173.78 6.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.217 -0.447 . . . . 62.21 110.853 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -56.59 -15.79 13.53 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.736 -0.745 . . . . 74.24 112.532 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -99.86 14.57 29.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.722 0.296 . . . . 75.03 111.023 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 143' ' ' HIS . . . . . 0.614 ' CB ' ' HB1' ' A' ' 139' ' ' ALA . 12.0 p80 -68.21 -33.45 74.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.246 -0.434 . . . . 71.11 110.875 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 147.13 47.01 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.808 -0.711 . . . . 45.51 112.475 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -158.49 149.86 20.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.829 0.347 . . . . 72.14 110.859 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 146' ' ' SER . . . . . 0.489 ' O ' ' CB ' ' A' ' 147' ' ' TYR . 37.6 m -63.66 98.39 0.18 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.166 -0.47 . . . . 51.25 110.847 -179.738 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 147' ' ' TYR . . . . . 0.489 ' CB ' ' O ' ' A' ' 146' ' ' SER . 0.2 OUTLIER 161.81 119.93 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.622 0.725 . . . . 73.4 110.939 -179.853 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.81 143.83 51.82 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.677 2.251 . . . . 74.53 112.324 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 149' ' ' PHE . . . . . 0.529 ' O ' ' CG ' ' A' ' 150' ' ' ASP . 0.2 OUTLIER -54.03 -22.73 11.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.133 -0.485 . . . . 63.52 110.845 -179.955 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 150' ' ' ASP . . . . . 0.529 ' CG ' ' O ' ' A' ' 149' ' ' PHE . 2.8 p30 50.12 18.55 0.4 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.227 -0.442 . . . . 63.11 110.818 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 41.17 -159.73 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.703 -0.761 . . . . 71.41 112.495 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 144.51 54.54 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.697 2.265 . . . . 75.11 112.382 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 153' ' ' GLY . . . . . 0.444 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 105.8 -134.33 12.05 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.699 -0.762 . . . . 70.32 112.535 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 154' ' ' ASN . . . . . 0.444 ' C ' ' O ' ' A' ' 153' ' ' GLY . 4.3 p30 -34.27 133.67 0.22 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.885 0.374 . . . . 73.25 110.888 -179.952 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 155' ' ' THR . . . . . 0.595 HG23 ' HA2' ' A' ' 68' ' ' GLY . 1.3 m 80.25 105.35 0.07 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.186 -0.461 . . . . 44.41 111.147 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 156' ' ' LEU . . . . . 0.972 HD21 HG21 ' A' ' 186' ' ' ILE . 0.6 OUTLIER -91.7 -55.53 3.44 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.236 -0.438 . . . . 75.02 110.965 179.895 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 157' ' ' ALA . . . . . 0.585 ' HB1' ' O ' ' A' ' 171' ' ' HIS . . . -158.45 148.4 19.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.186 -0.461 . . . . 71.42 111.161 179.771 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 158' ' ' HIS . . . . . 0.472 ' HB2' HG23 ' A' ' 69' ' ' VAL . 24.2 p-80 -111.24 116.33 30.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.243 -0.435 . . . . 72.02 110.845 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 159' ' ' ALA . . . . . 0.631 ' O ' HG21 ' A' ' 69' ' ' VAL . . . -110.86 151.46 27.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.228 -0.442 . . . . 74.42 111.114 179.904 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -118.73 161.17 20.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.216 -0.447 . . . . 75.31 110.845 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 161' ' ' ALA . . . . . 0.728 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -93.12 164.75 20.37 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.598 0.714 . . . . 61.04 111.061 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 162' ' ' PRO . . . . . 0.728 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.6 Cg_endo -69.86 84.43 0.67 Allowed 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.671 2.247 . . . . 74.44 112.323 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -115.21 117.1 3.9 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.718 -0.753 . . . . 61.41 112.507 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 2.5 m 72.68 -69.47 0.19 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.852 0.358 . . . . 73.1 111.162 -179.797 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . 179.08 -61.56 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.729 -0.748 . . . . 74.03 112.439 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 166' ' ' LEU . . . . . 0.804 HD22 ' C ' ' A' ' 166' ' ' LEU . 0.0 OUTLIER -53.91 -21.5 7.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.813 0.34 . . . . 65.12 110.898 -179.9 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 167' ' ' GLY . . . . . 0.717 ' N ' HD22 ' A' ' 166' ' ' LEU . . . -80.45 -171.5 43.68 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.736 -0.745 . . . . 43.43 112.473 179.908 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 72.88 21.11 80.01 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.723 -0.751 . . . . 74.31 112.523 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 76.8 m-20 -93.69 162.3 13.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.847 0.356 . . . . 63.41 110.889 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -113.34 131.35 55.99 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.145 -0.48 . . . . 74.21 111.064 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 171' ' ' HIS . . . . . 0.585 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 25.3 m170 -124.88 137.16 54.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.245 -0.434 . . . . 72.53 110.857 179.962 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 35.7 m-85 -118.73 139.27 51.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.179 -0.464 . . . . 71.44 110.91 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 55.3 t0 -72.24 100.99 2.72 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.16 -0.473 . . . . 74.11 110.857 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 174' ' ' GLU . . . . . 0.415 ' HG2' ' CD1' ' A' ' 138' ' ' PHE . 0.6 OUTLIER -57.86 -16.08 10.58 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.217 -0.447 . . . . 72.25 110.919 -179.879 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -79.32 -16.25 56.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.119 -0.492 . . . . 73.32 110.938 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 36.4 mm-40 -83.24 -179.51 7.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.18 -0.463 . . . . 63.2 110.878 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 1.5 mtt85 -116.26 113.71 23.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.116 -0.493 . . . . 63.14 110.829 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 5.8 m95 -116.64 147.91 41.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.271 -0.422 . . . . 72.31 110.905 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 179' ' ' THR . . . . . 0.712 ' HA ' HD21 ' A' ' 100' ' ' LEU . 9.2 t -178.73 163.56 1.46 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.246 -0.433 . . . . 74.13 111.194 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -121.7 -71.27 0.74 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.201 -0.454 . . . . 45.33 110.864 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -61.0 -14.9 40.67 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.787 -0.72 . . . . 62.41 112.451 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 182' ' ' SER . . . . . 0.611 ' HB3' HG21 ' A' ' 179' ' ' THR . 0.2 OUTLIER -94.89 -24.33 17.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.926 0.394 . . . . 64.5 110.886 -179.717 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 183' ' ' SER . . . . . 0.451 ' C ' ' O ' ' A' ' 182' ' ' SER . 30.8 m 32.78 59.21 0.42 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.144 -0.48 . . . . 64.12 110.821 -179.869 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 1.3 tt -116.73 -33.58 4.77 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.146 -0.479 . . . . 74.2 110.897 179.999 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -117.94 -137.95 5.88 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.697 -0.763 . . . . 73.01 112.531 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 186' ' ' ILE . . . . . 0.972 HG21 HD21 ' A' ' 156' ' ' LEU . 9.4 mm -79.48 97.58 2.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.859 0.361 . . . . 73.22 111.128 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -48.41 119.92 3.33 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.139 -0.482 . . . . 71.31 110.871 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 188' ' ' PHE . . . . . 0.727 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.5 t80 -54.16 -36.0 62.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.179 -0.464 . . . . 75.45 110.837 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 189' ' ' LEU . . . . . 0.469 HD21 ' CG ' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -67.55 -47.85 68.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.144 -0.48 . . . . 52.02 110.901 -179.928 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 54.6 t80 -69.5 -39.11 77.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.195 -0.457 . . . . 74.22 110.909 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 191' ' ' ALA . . . . . 0.666 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -72.52 -34.59 67.71 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.129 -0.487 . . . . 50.03 111.165 179.791 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 192' ' ' ALA . . . . . 0.652 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -56.17 -44.73 79.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.207 -0.451 . . . . 52.11 111.118 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 193' ' ' THR . . . . . 0.578 HG21 HG21 ' A' ' 211' ' ' VAL . 0.3 OUTLIER -57.97 -41.32 82.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.193 -0.458 . . . . 72.43 111.184 -179.958 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -73.02 -46.3 52.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.272 -0.422 . . . . 71.44 110.867 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -68.24 -47.71 67.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.187 -0.461 . . . . 71.01 111.141 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 196' ' ' LEU . . . . . 0.813 HD12 ' CD1' ' A' ' 113' ' ' LEU . 4.4 mm? -64.67 -41.86 95.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.152 -0.476 . . . . 74.51 110.95 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -55.07 -30.93 55.57 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.749 -0.738 . . . . 52.23 112.532 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 198' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 -66.97 -33.48 75.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.684 0.278 . . . . 75.21 110.839 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 5.5 t -68.5 -20.4 64.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.231 -0.44 . . . . 71.13 110.9 -179.778 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 200' ' ' LEU . . . . . 0.41 ' HA ' ' CD1' ' A' ' 84' ' ' TRP . 0.3 OUTLIER -90.57 -2.6 57.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.065 -0.516 . . . . 64.13 110.866 -179.968 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 84.27 8.75 83.12 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.796 -0.716 . . . . 50.41 112.519 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 202' ' ' MET . . . . . 0.455 ' HE1' ' HB ' ' A' ' 234' ' ' ILE . 32.9 tpp -67.54 142.13 56.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.829 0.347 . . . . 63.21 110.877 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -104.7 159.16 16.06 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.715 -0.755 . . . . 64.44 112.487 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 13.7 m-70 -58.58 159.35 6.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.795 0.331 . . . . 74.32 110.855 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 205' ' ' SER . . . . . 0.503 ' OG ' ' HB1' ' A' ' 210' ' ' ALA . 0.0 OUTLIER -121.09 150.05 41.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.251 -0.432 . . . . 53.34 110.817 -179.736 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 4.3 p -87.99 -4.2 58.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.157 -0.474 . . . . 72.22 110.846 -179.812 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.18 138.12 84.48 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.57 0.7 . . . . 65.11 110.879 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.84 -8.13 22.83 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.663 2.242 . . . . 74.53 112.319 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -126.56 29.36 5.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.221 -0.445 . . . . 63.52 110.941 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 210' ' ' ALA . . . . . 0.503 ' HB1' ' OG ' ' A' ' 205' ' ' SER . . . -87.36 145.53 26.28 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.156 -0.474 . . . . 62.23 111.109 179.908 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 211' ' ' VAL . . . . . 0.578 HG21 HG21 ' A' ' 193' ' ' THR . 0.4 OUTLIER -68.1 -28.34 40.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.215 -0.448 . . . . 62.04 111.147 179.954 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 21.0 mmm -96.97 9.89 40.72 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.169 -0.468 . . . . 75.22 110.893 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 213' ' ' TYR . . . . . 0.409 ' HA ' ' HD2' ' A' ' 214' ' ' PRO . 2.0 t80 -55.6 114.99 8.28 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-O 121.718 0.77 . . . . 73.43 110.949 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 214' ' ' PRO . . . . . 0.409 ' HD2' ' HA ' ' A' ' 213' ' ' TYR . 53.2 Cg_endo -69.72 -18.45 37.17 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.675 2.25 . . . . 63.01 112.316 -179.945 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -84.34 51.54 2.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.225 -0.443 . . . . 74.24 111.128 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 6.8 t80 . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 116.279 -0.419 . . . . 74.14 110.894 -179.919 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 224' ' ' PHE . . . . . 0.443 ' HE1' HG21 ' A' ' 193' ' ' THR . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.905 0.383 . . . . 65.01 110.858 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -143.54 161.63 37.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.168 -0.469 . . . . 64.24 110.828 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 226' ' ' LEU . . . . . 0.661 HD22 HD11 ' A' ' 231' ' ' ILE . 37.5 mt -66.52 148.26 52.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.193 -0.458 . . . . 53.44 110.895 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 227' ' ' SER . . . . . 0.433 ' HB3' ' HA ' ' A' ' 210' ' ' ALA . 0.0 OUTLIER -87.89 152.84 21.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.189 -0.459 . . . . 74.21 110.837 -179.94 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -65.58 -68.65 0.35 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.12 -0.491 . . . . 74.54 110.9 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 229' ' ' ASP . . . . . 0.415 ' O ' ' HG2' ' A' ' 232' ' ' LYS . 0.4 OUTLIER -56.3 -24.7 45.1 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.223 -0.444 . . . . 72.22 110.897 179.965 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 40.4 t0 -68.38 -49.84 57.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 74.23 110.868 180.0 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 231' ' ' ILE . . . . . 0.661 HD11 HD22 ' A' ' 226' ' ' LEU . 2.8 mm -69.82 -43.15 80.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.225 -0.443 . . . . 73.41 111.085 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 232' ' ' LYS . . . . . 0.415 ' HG2' ' O ' ' A' ' 229' ' ' ASP . 7.9 ptmt -57.58 -31.87 66.59 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.191 -0.459 . . . . 65.42 110.916 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -68.83 -45.54 64.09 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.714 -0.755 . . . . 63.43 112.486 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 234' ' ' ILE . . . . . 0.455 ' HB ' ' HE1' ' A' ' 202' ' ' MET . 5.5 tt -72.86 -34.36 46.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.724 0.297 . . . . 71.54 111.223 179.972 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -66.31 -26.89 67.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.116 -0.493 . . . . 70.33 110.956 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 236' ' ' LYS . . . . . 0.452 ' HE3' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.67 -22.48 58.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.169 -0.468 . . . . 51.21 110.927 179.925 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 237' ' ' LEU . . . . . 0.829 HD23 ' HD2' ' A' ' 83' ' ' LYS . 1.1 tp -97.24 -16.13 20.51 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.166 -0.47 . . . . 75.41 110.908 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 238' ' ' TYR . . . . . 0.649 ' CZ ' HD11 ' A' ' 122' ' ' LEU . 11.6 m-85 -105.39 -35.19 7.59 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.189 -0.459 . . . . 51.24 110.946 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.309 0 C-N-CA 120.726 -0.75 . . . . 32.22 112.46 179.986 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 37.5 t-105 . . . . . 0 C--O 1.23 0.051 0 CA-C-O 120.684 0.278 . . . . 71.22 110.923 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -72.98 -35.37 66.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.238 -0.437 . . . . 72.51 110.906 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -63.41 -36.78 84.88 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.156 -0.475 . . . . 61.24 110.881 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.618 ' HB1' ' CE ' ' A' ' 62' ' ' MET . . . -62.44 -34.87 77.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.223 -0.444 . . . . 54.34 111.14 179.93 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.44 ' OE1' HD22 ' A' ' 35' ' ' LEU . 2.4 tt0 -66.07 -43.0 88.64 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.155 -0.475 . . . . 73.12 110.95 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -76.81 -34.1 57.94 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.152 -0.477 . . . . 72.4 110.884 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -70.7 -35.91 73.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.15 -0.477 . . . . 75.11 110.911 -179.864 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.631 HD13 ' O ' ' A' ' 19' ' ' LEU . 3.2 tm? -68.31 -26.03 65.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.159 -0.473 . . . . 72.51 110.873 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.56 ' HA ' ' CE1' ' A' ' 23' ' ' TYR . 7.0 ptmt -68.87 -37.11 78.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.178 -0.464 . . . . 74.41 110.86 179.899 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.455 ' N ' ' HG2' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -79.4 -21.83 45.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.255 -0.43 . . . . 74.05 110.88 -179.996 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -55.41 -30.39 60.34 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.235 -0.439 . . . . 74.31 110.827 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.56 ' CE1' ' HA ' ' A' ' 20' ' ' LYS . 44.9 p90 . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.104 -0.498 . . . . 72.55 110.923 -179.823 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.626 HD11 HD21 ' A' ' 39' ' ' LEU . 35.1 tp . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.746 0.308 . . . . 72.52 110.891 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -56.76 -50.7 71.49 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.146 -0.479 . . . . 73.13 110.933 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.55 -36.59 83.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.202 -0.454 . . . . 63.32 111.089 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.403 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.0 OUTLIER -69.43 -48.62 60.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.254 -0.43 . . . . 72.32 110.935 179.961 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.746 ' CD1' HD23 ' A' ' 54' ' ' LEU . 10.2 mt -54.42 -38.59 66.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.159 -0.473 . . . . 72.11 110.937 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.0 ttmm -58.75 -46.1 88.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.166 -0.47 . . . . 62.43 110.828 179.881 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.403 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 1.6 pt-20 -70.11 -33.35 71.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.221 -0.445 . . . . 75.11 110.842 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.707 ' CE ' HD11 ' A' ' 61' ' ' ILE . 4.2 ttt -68.27 -46.43 70.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.222 -0.445 . . . . 63.43 110.861 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.513 ' CB ' HG22 ' A' ' 51' ' ' THR . 1.7 mt-30 -63.96 -41.77 97.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.254 -0.43 . . . . 74.45 110.911 -179.943 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.445 ' HE3' HG21 ' A' ' 51' ' ' THR . 8.4 mmtt -66.69 -25.44 66.54 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.147 -0.478 . . . . 71.43 110.837 -179.93 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 38.2 t80 -69.66 -37.03 76.55 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.29 -0.414 . . . . 73.32 110.88 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.597 ' CZ ' HD12 ' A' ' 61' ' ' ILE . 11.8 m-85 -81.27 -31.47 33.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.174 -0.466 . . . . 70.43 110.901 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 104.55 -10.1 49.34 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.776 -0.726 . . . . 64.34 112.469 180.0 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.546 HD23 ' HB3' ' A' ' 46' ' ' PHE . 0.5 OUTLIER -61.62 144.13 93.02 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.612 0.72 . . . . 64.11 110.922 -179.923 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.501 ' O ' HG23 ' A' ' 51' ' ' THR . 53.4 Cg_endo -69.72 -54.66 0.21 Allowed 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.66 2.24 . . . . 74.5 112.307 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.545 HD12 ' CG2' ' A' ' 58' ' ' VAL . 0.8 OUTLIER -51.04 108.26 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.248 -0.433 . . . . 71.22 111.132 179.988 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.513 HG22 ' CB ' ' A' ' 43' ' ' GLN . 40.3 p -123.38 157.41 33.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.214 -0.448 . . . . 73.25 111.129 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 84.06 -10.85 59.49 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.742 -0.742 . . . . 64.24 112.491 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 1.2 mtt -135.16 156.81 48.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.895 0.379 . . . . 75.23 110.874 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.746 HD23 ' CD1' ' A' ' 39' ' ' LEU . 1.9 pp -156.99 129.15 7.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.2 -0.455 . . . . 73.4 110.917 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 173.87 -29.33 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.216 -0.447 . . . . 44.35 110.936 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 26.1 t -94.16 -89.15 0.23 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.116 -0.493 . . . . 75.25 110.859 -179.871 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.599 ' O ' HG23 ' A' ' 61' ' ' ILE . 7.6 tpt180 -84.76 -35.99 22.05 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.118 -0.492 . . . . 61.22 110.919 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.545 ' CG2' HD12 ' A' ' 50' ' ' ILE . 21.8 t -60.26 -41.73 88.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.132 -0.485 . . . . 70.12 111.132 179.941 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.402 HD13 ' HB2' ' A' ' 62' ' ' MET . 0.2 OUTLIER -74.67 -31.01 25.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.192 -0.458 . . . . 74.43 111.133 179.939 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -59.97 -43.79 94.88 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.128 -0.487 . . . . 73.45 110.921 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.707 HD11 ' CE ' ' A' ' 42' ' ' MET . 0.7 OUTLIER -65.92 -29.78 47.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.148 -0.478 . . . . 74.52 111.167 179.893 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 62' ' ' MET . . . . . 0.618 ' CE ' ' HB1' ' A' ' 15' ' ' ALA . 3.9 mmm -70.39 -33.75 71.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.133 -0.485 . . . . 74.01 110.889 179.863 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -88.08 -25.88 22.82 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.202 -0.454 . . . . 42.22 110.898 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.1 mtmp? -85.04 151.93 58.03 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.553 0.692 . . . . 65.34 110.927 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' PRO . . . . . 0.545 ' HB2' HD22 ' A' ' 156' ' ' LEU . 53.8 Cg_endo -69.77 143.68 51.57 Favored 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.695 2.264 . . . . 72.11 112.381 179.879 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 25.8 ttp180 -141.36 -85.52 0.18 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.273 -0.421 . . . . 71.51 110.855 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 16.2 p -145.67 143.75 29.99 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.233 -0.439 . . . . 55.3 110.894 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.636 ' HA2' HG23 ' A' ' 155' ' ' THR . . . -89.08 11.87 68.01 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.683 -0.77 . . . . 64.23 112.466 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.493 HG12 ' HD2' ' A' ' 70' ' ' PRO . 0.1 OUTLIER -116.93 141.4 28.25 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.577 0.703 . . . . 74.23 111.139 -179.987 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 70' ' ' PRO . . . . . 0.493 ' HD2' HG12 ' A' ' 69' ' ' VAL . 53.6 Cg_endo -69.74 178.12 4.87 Favored 'Trans proline' 0 N--CA 1.465 -0.148 0 C-N-CA 122.719 2.28 . . . . 63.44 112.316 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -128.68 42.63 3.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.204 -0.453 . . . . 74.45 110.798 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.226 -0.443 . . . . 53.43 111.105 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo . . . . . 0 C--O 1.231 0.133 0 CA-C-O 120.841 0.267 . . . . 71.11 112.311 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.708 ' HD3' HD22 ' A' ' 237' ' ' LEU . 5.1 mtpt -106.78 155.24 19.91 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.231 -0.441 . . . . 64.45 110.934 179.904 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' TRP . . . . . 0.652 ' CE3' HG21 ' A' ' 89' ' ' VAL . 38.4 m0 -50.11 112.33 0.66 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.21 -0.45 . . . . 73.31 110.938 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -115.37 -8.1 12.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.251 -0.432 . . . . 65.3 111.105 -179.894 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -59.57 176.13 0.29 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.23 -0.441 . . . . 70.34 110.84 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.34 -30.78 25.21 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.075 -0.512 . . . . 71.12 110.832 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -156.79 144.48 10.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.269 -0.423 . . . . 74.14 111.113 179.865 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.652 HG21 ' CE3' ' A' ' 84' ' ' TRP . 21.7 t -129.33 134.53 63.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.14 -0.482 . . . . 72.25 111.116 179.926 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.461 ' C ' ' HB1' ' A' ' 132' ' ' ALA . 22.0 p -115.66 151.84 34.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.213 -0.449 . . . . 71.01 111.137 -179.943 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 4.6 p90 -132.2 146.01 51.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.227 -0.442 . . . . 70.51 110.937 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 9.4 ttt180 -146.61 136.5 23.33 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.088 -0.505 . . . . 71.25 110.828 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.419 HD11 ' HA ' ' A' ' 106' ' ' ASP . 10.4 mm -75.87 134.18 29.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.154 -0.475 . . . . 72.4 111.092 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.45 ' HB ' ' HA3' ' A' ' 137' ' ' GLY . 15.1 t -92.29 -40.37 12.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.174 -0.466 . . . . 60.2 111.196 179.776 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -150.41 169.45 21.41 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.16 -0.473 . . . . 64.24 110.848 -179.863 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 16.7 p90 -132.24 155.25 48.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.201 -0.454 . . . . 72.25 110.926 -179.838 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 2.9 t -99.72 141.89 31.93 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.076 -0.511 . . . . 64.11 111.126 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.4 -18.02 1.45 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.195 -0.457 . . . . 72.14 110.876 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -65.02 -35.95 82.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.183 -0.462 . . . . 74.13 110.839 -180.0 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.493 HD23 HG21 ' A' ' 104' ' ' THR . 1.8 mp -144.24 152.45 54.2 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.554 0.693 . . . . 72.52 110.959 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 101' ' ' PRO . . . . . 0.582 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.2 Cg_endo -69.79 151.07 68.77 Favored 'Trans proline' 0 C--O 1.232 0.216 0 C-N-CA 122.717 2.278 . . . . 73.11 112.32 179.927 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 -51.07 -26.66 6.67 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.173 -0.467 . . . . 74.11 110.901 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.582 HG22 ' HB2' ' A' ' 101' ' ' PRO . 10.5 tp -76.74 -38.45 30.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.181 -0.463 . . . . 74.02 111.101 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 104' ' ' THR . . . . . 0.642 ' O ' HD22 ' A' ' 108' ' ' LEU . 3.2 m -68.86 -39.47 79.85 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.197 -0.456 . . . . 52.11 111.198 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.756 ' O ' HG13 ' A' ' 109' ' ' VAL . 69.9 t -73.0 -45.29 55.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.21 -0.45 . . . . 71.51 111.101 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.662 ' O ' HG22 ' A' ' 109' ' ' VAL . 43.3 t0 -60.39 -44.96 95.16 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.213 -0.449 . . . . 63.44 110.903 179.873 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 11.5 ptm180 -70.15 -33.5 71.88 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.183 -0.462 . . . . 75.02 110.925 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.642 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -60.68 -48.89 79.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.193 -0.458 . . . . 71.04 110.922 -179.984 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.756 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.5 m -55.44 -41.68 63.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.156 -0.475 . . . . 72.31 111.197 179.845 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.465 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 47.7 t -70.11 -33.57 72.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.173 -0.467 . . . . 72.14 110.875 -179.902 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.465 ' HB3' HD21 ' A' ' 189' ' ' LEU . 0.4 OUTLIER -61.96 -33.01 73.5 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.091 -0.504 . . . . 74.35 110.892 179.929 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.29 -40.32 9.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.26 -0.427 . . . . 74.32 111.049 179.88 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 1.016 HD13 HD12 ' A' ' 196' ' ' LEU . 6.4 tp -65.31 -32.54 74.25 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.29 -0.413 . . . . 72.0 110.884 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -65.37 -38.4 89.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.213 -0.449 . . . . 72.34 110.87 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 115' ' ' MET . . . . . 0.641 ' O ' HD11 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -62.24 -34.48 76.58 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.232 -0.44 . . . . 54.12 110.883 179.856 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 7.1 m95 -67.04 -52.41 42.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.223 -0.444 . . . . 75.23 110.863 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -59.65 -37.87 92.93 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.718 -0.753 . . . . 73.32 112.522 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.1 mmpt? -61.34 -17.07 52.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.729 0.3 . . . . 72.42 110.872 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.819 ' HG2' HD13 ' A' ' 226' ' ' LEU . 0.5 OUTLIER -98.99 12.85 34.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.242 -0.436 . . . . 75.24 110.902 179.992 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 1.9 pt -148.28 145.76 21.35 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.711 0.767 . . . . 71.34 111.059 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.84 6.32 1.38 Allowed 'Trans proline' 0 C--N 1.343 0.249 0 C-N-CA 122.678 2.252 . . . . 72.21 112.341 179.889 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.433 ' HA ' HD23 ' A' ' 122' ' ' LEU . 4.1 mt -62.77 -156.95 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.203 -0.453 . . . . 73.22 110.962 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 21.8 t-80 -154.6 123.15 6.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.284 -0.416 . . . . 74.12 110.882 179.882 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 9.2 m-30 -108.23 133.14 52.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.224 -0.444 . . . . 75.54 110.868 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.425 ' O ' HG22 ' A' ' 90' ' ' THR . 0.0 OUTLIER -119.29 141.66 48.78 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.165 -0.47 . . . . 75.14 110.921 -179.915 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.82 160.27 24.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.197 -0.456 . . . . 72.22 110.852 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 127' ' ' VAL . . . . . 0.731 HG11 ' HB2' ' A' ' 132' ' ' ALA . 18.2 m -103.1 126.61 57.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.185 -0.462 . . . . 50.13 111.102 179.858 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.583 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -146.96 -13.35 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.157 -0.474 . . . . 74.43 111.138 179.896 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 129' ' ' TRP . . . . . 0.583 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -153.65 109.05 3.2 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.173 -0.467 . . . . 71.25 110.89 179.919 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 102.45 -165.09 16.66 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.804 -0.712 . . . . 62.11 112.541 179.97 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.99 155.67 18.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.824 0.345 . . . . 63.25 111.093 -179.835 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 132' ' ' ALA . . . . . 0.731 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -112.37 165.7 11.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.213 -0.449 . . . . 51.34 111.06 179.811 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -76.34 -41.67 47.53 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.19 -0.459 . . . . 75.41 110.885 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 134' ' ' ILE . . . . . 0.65 HG23 ' O ' ' A' ' 168' ' ' GLY . 3.9 mm -94.76 107.83 19.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.185 -0.461 . . . . 70.51 111.146 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 135' ' ' MET . . . . . 0.433 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 9.3 mmm -98.59 122.5 41.87 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.152 -0.476 . . . . 72.43 110.929 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -106.28 95.23 3.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.262 -0.426 . . . . 70.04 111.162 179.99 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 137' ' ' GLY . . . . . 0.45 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -132.6 165.93 23.63 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.755 -0.736 . . . . 63.34 112.495 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 138' ' ' PHE . . . . . 0.539 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 2.8 m-85 -107.11 147.07 30.49 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.838 0.351 . . . . 74.01 110.872 -179.844 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.539 ' HB2' ' O ' ' A' ' 138' ' ' PHE . . . 170.96 166.35 0.08 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.166 -0.47 . . . . 71.21 111.131 179.894 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 34.8 mtp180 -105.05 173.57 6.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.183 -0.462 . . . . 62.21 110.87 -179.9 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -53.51 -22.02 15.36 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.742 -0.742 . . . . 74.24 112.455 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -67.48 -10.9 55.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.827 0.346 . . . . 75.03 111.163 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 2.5 p80 -68.81 -11.91 60.94 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 71.11 110.865 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 118.63 39.57 0.71 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.736 -0.745 . . . . 45.51 112.454 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -123.3 141.1 52.33 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.748 0.309 . . . . 72.14 110.872 -179.952 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 3.0 m -64.23 156.03 30.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.219 -0.446 . . . . 51.25 110.902 -179.802 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 64.93 133.24 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.691 0.758 . . . . 73.4 110.881 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 134.67 28.52 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.712 2.275 . . . . 74.53 112.358 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -66.99 -29.69 69.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.26 -0.427 . . . . 63.52 110.865 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 75.21 -2.8 2.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.118 -0.492 . . . . 63.11 110.94 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 57.0 -117.3 9.31 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.718 -0.753 . . . . 71.41 112.475 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 138.9 38.82 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.649 2.233 . . . . 75.11 112.34 -179.912 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 103.16 -147.9 17.02 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.779 -0.724 . . . . 70.32 112.501 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -39.97 149.04 0.07 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.887 0.375 . . . . 73.25 110.9 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 155' ' ' THR . . . . . 0.636 HG23 ' HA2' ' A' ' 68' ' ' GLY . 0.9 OUTLIER 75.99 110.55 0.07 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.158 -0.474 . . . . 44.41 111.131 -179.957 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 156' ' ' LEU . . . . . 1.002 HD21 HG21 ' A' ' 186' ' ' ILE . 0.6 OUTLIER -96.1 -53.35 3.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.133 -0.485 . . . . 75.02 110.882 179.995 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 157' ' ' ALA . . . . . 0.573 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -161.63 147.71 13.91 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.209 -0.451 . . . . 71.42 111.069 179.8 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 24.5 p-80 -109.63 125.72 52.88 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 72.02 110.86 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -109.41 171.25 7.55 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.193 -0.458 . . . . 74.42 111.105 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -125.9 153.28 44.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 75.31 110.856 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 161' ' ' ALA . . . . . 0.757 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -86.27 165.46 33.54 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.605 0.717 . . . . 61.04 111.061 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 162' ' ' PRO . . . . . 0.757 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.7 Cg_endo -69.73 75.52 1.19 Allowed 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.696 2.264 . . . . 74.44 112.36 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -136.29 102.61 0.41 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.708 -0.758 . . . . 61.41 112.481 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 164' ' ' THR . . . . . 0.442 HG22 ' H ' ' A' ' 165' ' ' GLY . 0.2 OUTLIER 68.28 174.5 0.28 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.775 0.321 . . . . 73.1 111.135 -179.908 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 165' ' ' GLY . . . . . 0.442 ' H ' HG22 ' A' ' 164' ' ' THR . . . -52.07 -50.65 44.55 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.739 -0.743 . . . . 74.03 112.502 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 166' ' ' LEU . . . . . 0.675 HD13 ' O ' ' A' ' 166' ' ' LEU . 3.4 tm? -58.71 -31.19 68.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.845 0.355 . . . . 65.12 110.915 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -72.97 151.22 45.42 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.669 -0.777 . . . . 43.43 112.481 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 168' ' ' GLY . . . . . 0.65 ' O ' HG23 ' A' ' 134' ' ' ILE . . . 86.2 15.99 63.57 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.782 -0.723 . . . . 74.31 112.472 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -87.37 147.88 25.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.791 0.329 . . . . 63.41 110.898 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.58 130.38 56.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 74.21 111.088 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 171' ' ' HIS . . . . . 0.55 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 50.0 m170 -131.43 139.04 49.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.244 -0.435 . . . . 72.53 110.807 -179.948 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 48.5 m-85 -122.34 140.07 53.08 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.184 -0.462 . . . . 71.44 110.858 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 63.5 t0 -69.14 98.25 0.99 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.196 -0.456 . . . . 74.11 110.853 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.94 -16.46 12.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.157 -0.474 . . . . 72.25 110.857 -179.886 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -79.25 -16.25 56.76 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.112 -0.494 . . . . 73.32 110.85 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 27.8 mm-40 -81.99 -176.78 6.31 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.166 -0.47 . . . . 63.2 110.918 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 32.3 mtm180 -116.49 114.4 24.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 63.14 110.917 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 5.7 m95 -117.24 150.33 38.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.244 -0.434 . . . . 72.31 110.855 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 179' ' ' THR . . . . . 0.581 HG21 ' HB3' ' A' ' 182' ' ' SER . 12.2 t -179.82 163.87 1.16 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.231 -0.441 . . . . 74.13 111.14 -179.934 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -122.27 -67.53 0.95 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.253 -0.43 . . . . 45.33 110.839 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -67.49 -10.73 58.29 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.748 -0.739 . . . . 62.41 112.495 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 182' ' ' SER . . . . . 0.581 ' HB3' HG21 ' A' ' 179' ' ' THR . 0.2 OUTLIER -98.28 -24.51 15.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.856 0.36 . . . . 64.5 110.888 -179.768 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 183' ' ' SER . . . . . 0.458 ' C ' ' O ' ' A' ' 182' ' ' SER . 53.0 p 32.69 61.58 0.36 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.085 -0.507 . . . . 64.12 110.877 -179.83 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 6.0 tt -116.89 -33.7 4.68 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 74.2 110.894 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -121.33 -136.45 5.04 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.734 -0.746 . . . . 73.01 112.503 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 186' ' ' ILE . . . . . 1.002 HG21 HD21 ' A' ' 156' ' ' LEU . 7.7 mm -79.36 97.41 2.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.871 0.367 . . . . 73.22 111.165 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -50.94 121.32 5.84 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.154 -0.476 . . . . 71.31 110.879 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 188' ' ' PHE . . . . . 0.753 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.5 t80 -54.2 -35.68 62.64 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.224 -0.444 . . . . 75.45 110.913 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 189' ' ' LEU . . . . . 0.52 HD12 ' HE2' ' A' ' 224' ' ' PHE . 0.2 OUTLIER -67.37 -48.17 68.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.094 -0.503 . . . . 52.02 110.865 -179.998 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 9.7 t80 -69.88 -37.45 76.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.152 -0.476 . . . . 74.22 110.935 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 191' ' ' ALA . . . . . 0.662 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -72.55 -35.9 68.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.099 -0.501 . . . . 50.03 111.092 179.895 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 192' ' ' ALA . . . . . 0.66 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -57.13 -45.19 83.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.251 -0.431 . . . . 52.11 111.105 179.952 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.78 -41.03 85.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.189 -0.46 . . . . 72.43 111.162 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 13.9 t-160 -73.1 -44.97 59.66 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.215 -0.448 . . . . 71.44 110.872 179.89 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -69.48 -48.15 61.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.244 -0.435 . . . . 71.01 111.101 179.894 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 196' ' ' LEU . . . . . 1.016 HD12 HD13 ' A' ' 113' ' ' LEU . 4.4 mm? -64.06 -39.42 94.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.114 -0.493 . . . . 74.51 110.909 -179.908 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -63.31 -25.15 68.13 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.745 -0.741 . . . . 52.23 112.526 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 198' ' ' HIS . . . . . . . . . . . . . 5.5 m-70 -68.7 -43.6 75.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.834 0.35 . . . . 75.21 110.857 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 199' ' ' SER . . . . . 0.46 ' O ' ' HD3' ' A' ' 162' ' ' PRO . 0.2 OUTLIER -58.83 -25.68 63.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.233 -0.439 . . . . 71.13 110.921 -179.788 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -85.05 1.13 49.11 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.104 -0.498 . . . . 64.13 110.891 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 85.19 -9.36 67.02 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.787 -0.72 . . . . 50.41 112.525 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 202' ' ' MET . . . . . 0.448 ' CE ' ' HB ' ' A' ' 234' ' ' ILE . 0.0 OUTLIER -54.2 134.52 44.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.808 0.337 . . . . 63.21 110.828 -179.964 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -101.05 172.69 23.66 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.719 -0.753 . . . . 64.44 112.465 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 204' ' ' HIS . . . . . 0.42 ' HA ' ' HB3' ' A' ' 212' ' ' MET . 20.7 m-70 -67.45 163.64 20.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.827 0.346 . . . . 74.32 110.864 -179.96 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -124.66 153.47 42.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.223 -0.444 . . . . 53.34 110.856 -179.781 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 3.1 p -87.64 -4.27 58.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.156 -0.475 . . . . 72.22 110.819 -179.775 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.19 135.88 84.62 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.58 0.705 . . . . 65.11 110.924 179.952 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -69.83 -6.15 17.95 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.594 2.196 . . . . 74.53 112.292 -179.855 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -130.05 29.96 4.87 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.227 -0.442 . . . . 63.52 110.9 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 210' ' ' ALA . . . . . 0.478 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.27 145.33 26.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.142 -0.481 . . . . 62.23 111.09 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 211' ' ' VAL . . . . . 0.448 HG12 ' OD2' ' A' ' 230' ' ' ASP . 0.4 OUTLIER -67.21 -27.67 39.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.153 -0.476 . . . . 62.04 111.199 179.933 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 212' ' ' MET . . . . . 0.42 ' HB3' ' HA ' ' A' ' 204' ' ' HIS . 1.3 ttm -97.11 8.61 44.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.13 -0.486 . . . . 75.22 110.861 179.918 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 213' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -55.78 116.55 12.44 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.697 0.761 . . . . 73.43 110.845 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.89 -18.41 36.43 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.711 2.274 . . . . 63.01 112.282 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.7 51.1 2.05 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.239 -0.437 . . . . 74.24 111.139 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 8.4 t80 . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.265 -0.425 . . . . 74.14 110.974 -179.93 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 224' ' ' PHE . . . . . 0.52 ' HE2' HD12 ' A' ' 189' ' ' LEU . 0.3 OUTLIER . . . . . 0 CA--C 1.527 0.073 0 CA-C-O 120.92 0.391 . . . . 65.01 110.862 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 3.0 mttp -144.51 168.99 18.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.093 -0.503 . . . . 64.24 110.866 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 226' ' ' LEU . . . . . 0.819 HD13 ' HG2' ' A' ' 119' ' ' GLU . 21.9 mt -60.08 148.82 34.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 53.44 110.845 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 227' ' ' SER . . . . . 0.505 ' O ' HG12 ' A' ' 231' ' ' ILE . 0.0 OUTLIER -86.93 150.78 23.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.147 -0.479 . . . . 74.21 110.853 -179.95 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -64.38 -64.21 0.94 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.113 -0.494 . . . . 74.54 110.859 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 229' ' ' ASP . . . . . 0.404 ' HA ' ' HG2' ' A' ' 232' ' ' LYS . 17.9 t70 -55.48 -26.92 45.21 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.174 -0.466 . . . . 72.22 110.864 -179.982 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 230' ' ' ASP . . . . . 0.448 ' OD2' HG12 ' A' ' 211' ' ' VAL . 61.7 t0 -69.73 -50.23 45.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.155 -0.475 . . . . 74.23 110.896 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 231' ' ' ILE . . . . . 0.675 HD11 HD22 ' A' ' 226' ' ' LEU . 3.9 mm -69.75 -40.59 79.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.183 -0.462 . . . . 73.41 111.154 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 232' ' ' LYS . . . . . 0.411 ' HG3' ' N ' ' A' ' 233' ' ' GLY . 0.0 OUTLIER -56.46 -31.93 64.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.222 -0.445 . . . . 65.42 110.918 179.835 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 233' ' ' GLY . . . . . 0.411 ' N ' ' HG3' ' A' ' 232' ' ' LYS . . . -64.82 -49.72 62.04 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.729 -0.748 . . . . 63.43 112.529 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 234' ' ' ILE . . . . . 0.448 ' HB ' ' CE ' ' A' ' 202' ' ' MET . 8.4 tt -72.99 -30.28 31.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 120.76 0.314 . . . . 71.54 111.104 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -61.46 -29.29 69.87 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.233 -0.439 . . . . 70.33 110.896 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 236' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.58 -25.46 59.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.267 -0.424 . . . . 51.21 110.887 -179.998 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 237' ' ' LEU . . . . . 0.708 HD22 ' HD3' ' A' ' 83' ' ' LYS . 9.7 tt -97.42 -26.22 14.93 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.259 -0.428 . . . . 75.41 110.899 179.89 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 238' ' ' TYR . . . . . 0.44 ' CD1' HG13 ' A' ' 234' ' ' ILE . 5.4 m-85 -92.44 -35.38 13.69 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.235 -0.439 . . . . 51.24 110.881 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.314 0 C-N-CA 120.735 -0.745 . . . . 32.22 112.482 179.958 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 6.5 t-105 . . . . . 0 C--O 1.232 0.15 0 CA-C-O 120.668 0.271 . . . . 71.22 110.847 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -63.96 -36.67 84.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.341 -0.39 . . . . 72.51 110.902 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -63.07 -36.89 85.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 61.24 110.897 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.646 ' HB1' ' HE3' ' A' ' 62' ' ' MET . . . -57.16 -37.36 71.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.166 -0.47 . . . . 54.34 111.099 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.551 ' OE1' HD12 ' A' ' 35' ' ' LEU . 1.9 tt0 -67.16 -43.0 83.38 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.2 -0.455 . . . . 73.12 110.917 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -70.08 -31.41 68.99 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.162 -0.472 . . . . 72.4 110.882 180.0 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 14.8 m-85 -67.68 -50.5 57.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.188 -0.46 . . . . 75.11 110.948 -179.892 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.488 HD13 ' C ' ' A' ' 19' ' ' LEU . 2.8 tm? -67.82 -33.46 74.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.094 -0.503 . . . . 72.51 110.836 -179.94 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 4.9 tptt -57.15 -39.82 76.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.196 -0.456 . . . . 74.41 110.902 179.849 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.8 ptm180 -83.91 -25.29 30.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.242 -0.435 . . . . 74.05 110.917 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.427 ' HB2' ' HA ' ' A' ' 19' ' ' LEU . 0.4 OUTLIER -59.08 -20.17 50.93 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 74.31 110.865 -179.936 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 3.8 p90 . . . . . 0 C--N 1.328 -0.357 0 CA-C-N 116.182 -0.463 . . . . 72.55 110.958 -179.868 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.551 HD12 ' OE1' ' A' ' 16' ' ' GLN . 1.3 tt . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.77 0.319 . . . . 72.52 110.861 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.445 ' N ' HD23 ' A' ' 35' ' ' LEU . 1.1 tp10 -57.24 -52.64 64.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.268 -0.424 . . . . 73.13 110.931 179.911 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.48 -36.76 84.83 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.153 -0.476 . . . . 63.32 111.1 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.459 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 2.7 mmtm -65.19 -49.13 70.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.189 -0.46 . . . . 72.32 110.861 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 35' ' ' LEU . 4.6 mt -62.64 -35.54 79.93 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.209 -0.45 . . . . 72.11 110.874 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 26.0 tttt -60.1 -45.6 92.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.191 -0.459 . . . . 62.43 110.888 179.841 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.459 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 1.7 pt-20 -60.56 -32.73 71.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.192 -0.458 . . . . 75.11 110.877 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.537 ' HE2' HD11 ' A' ' 61' ' ' ILE . 13.9 ttt -65.68 -34.05 77.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.145 -0.48 . . . . 63.43 110.887 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.752 ' OE1' HD11 ' A' ' 48' ' ' LEU . 2.7 mm-40 -64.11 -39.65 94.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.239 -0.437 . . . . 74.45 110.847 -179.929 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.2 mmpt? -68.52 -29.21 67.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.192 -0.458 . . . . 71.43 110.915 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -70.05 -42.31 73.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 73.32 110.923 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.584 ' HB3' HD23 ' A' ' 48' ' ' LEU . 10.4 m-85 -82.1 -35.33 28.7 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.206 -0.452 . . . . 70.43 110.803 -179.871 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.402 ' HA3' ' HB2' ' A' ' 206' ' ' SER . . . 104.74 -10.15 48.68 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.718 -0.753 . . . . 64.34 112.414 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.752 HD11 ' OE1' ' A' ' 43' ' ' GLN . 0.7 OUTLIER -60.66 138.57 93.05 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.607 0.718 . . . . 64.11 110.941 -179.927 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.702 ' O ' HG23 ' A' ' 51' ' ' THR . 53.9 Cg_endo -69.73 -53.25 0.28 Allowed 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.643 2.229 . . . . 74.5 112.386 179.844 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.438 ' O ' HD12 ' A' ' 48' ' ' LEU . 0.9 OUTLIER -52.39 108.23 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.242 -0.435 . . . . 71.22 111.137 179.847 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.702 HG23 ' O ' ' A' ' 49' ' ' PRO . 68.2 p -116.22 168.53 10.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.214 -0.448 . . . . 73.25 111.174 179.917 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 65.19 12.51 55.52 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.763 -0.732 . . . . 64.24 112.495 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.2 ppp? -124.72 161.12 27.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.836 0.35 . . . . 75.23 110.868 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.546 HD21 ' CB ' ' A' ' 15' ' ' ALA . 18.4 tp -162.53 94.03 0.86 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.213 -0.449 . . . . 73.4 110.933 179.999 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.413 ' HA ' HG13 ' A' ' 59' ' ' ILE . 0.6 OUTLIER 172.9 -26.13 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.122 -0.49 . . . . 44.35 110.927 179.963 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 44.3 m -89.34 -100.5 0.09 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.171 -0.468 . . . . 75.25 110.851 -179.819 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 12.9 tpt180 -84.62 -28.23 26.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.126 -0.488 . . . . 61.22 110.874 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.495 HG21 HE22 ' A' ' 43' ' ' GLN . 97.3 t -62.68 -41.33 91.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.218 -0.446 . . . . 70.12 111.112 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.427 HD11 ' HB2' ' A' ' 15' ' ' ALA . 1.8 mm -74.97 -31.58 25.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.177 -0.465 . . . . 74.43 111.167 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -60.06 -44.12 94.95 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 73.45 110.86 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.653 HG21 HG23 ' A' ' 215' ' ' THR . 24.4 pt -70.34 -30.01 41.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.175 -0.466 . . . . 74.52 111.147 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' MET . . . . . 0.646 ' HE3' ' HB1' ' A' ' 15' ' ' ALA . 2.1 mmm -67.77 -35.26 78.38 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.144 -0.48 . . . . 74.01 110.832 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -87.67 -24.06 24.02 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.209 -0.451 . . . . 42.22 110.861 -179.874 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 50.5 mtmt -85.02 113.88 52.61 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.596 0.712 . . . . 65.34 110.864 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.78 148.05 64.07 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.71 2.273 . . . . 72.11 112.361 179.881 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.563 ' O ' HD23 ' A' ' 156' ' ' LEU . 1.5 ppt_? -154.7 -59.48 0.11 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.252 -0.431 . . . . 71.51 110.829 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -146.14 144.88 30.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.215 -0.448 . . . . 55.3 110.884 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.554 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -101.75 15.37 57.09 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.781 -0.723 . . . . 64.23 112.491 -179.922 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.598 HG12 ' HD2' ' A' ' 70' ' ' PRO . 0.1 OUTLIER -101.86 137.0 19.41 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.642 0.734 . . . . 74.23 111.111 -179.982 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 70' ' ' PRO . . . . . 0.598 ' HD2' HG12 ' A' ' 69' ' ' VAL . 54.2 Cg_endo -69.82 165.41 31.12 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.632 2.221 . . . . 63.44 112.387 179.904 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -135.01 46.27 2.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.253 -0.43 . . . . 74.45 110.867 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.263 -0.426 . . . . 53.43 111.066 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo . . . . . 0 C--O 1.231 0.172 0 CA-C-O 120.798 0.249 . . . . 71.11 112.308 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.821 ' HD2' HD22 ' A' ' 237' ' ' LEU . 5.4 mttp -63.34 151.02 41.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.269 -0.423 . . . . 64.45 110.898 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' TRP . . . . . 0.686 ' CE3' HG21 ' A' ' 89' ' ' VAL . 39.7 m0 -50.97 109.49 0.33 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.198 -0.455 . . . . 73.31 110.961 179.902 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -105.02 -14.7 15.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.25 -0.432 . . . . 65.3 111.183 -179.957 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -58.16 153.5 14.82 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.188 -0.46 . . . . 70.34 110.897 -179.879 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 14.6 mmtp -65.91 -30.62 71.24 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.178 -0.465 . . . . 71.12 110.91 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -154.79 142.25 12.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.208 -0.451 . . . . 74.14 111.132 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.686 HG21 ' CE3' ' A' ' 84' ' ' TRP . 54.8 t -123.61 139.21 50.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.183 -0.462 . . . . 72.25 111.082 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.488 ' C ' ' HB1' ' A' ' 132' ' ' ALA . 31.6 p -115.96 147.12 41.5 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.113 -0.494 . . . . 71.01 111.099 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 17.5 p90 -131.36 146.6 52.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.21 -0.45 . . . . 70.51 110.971 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 9.1 ttt180 -147.71 138.47 23.31 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.082 -0.508 . . . . 71.25 110.897 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.517 HD11 ' HA ' ' A' ' 106' ' ' ASP . 9.8 mm -75.21 135.09 27.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.223 -0.444 . . . . 72.4 111.156 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.456 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 21.1 t -91.47 -40.27 12.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.187 -0.461 . . . . 60.2 111.142 179.829 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 35.1 t -151.05 169.36 22.02 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.196 -0.456 . . . . 64.24 110.807 -179.835 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 13.2 p90 -131.86 155.09 48.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.078 -0.51 . . . . 72.25 110.95 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.7 t -103.32 141.71 35.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.129 -0.487 . . . . 64.11 111.14 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 2.1 mmt180 -52.53 -18.45 1.72 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.214 -0.448 . . . . 72.14 110.842 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.03 -37.42 87.54 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.199 -0.455 . . . . 74.13 110.86 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.617 HD11 ' HA ' ' A' ' 179' ' ' THR . 0.9 OUTLIER -142.09 152.4 61.45 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.594 0.711 . . . . 72.52 110.895 -179.957 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 101' ' ' PRO . . . . . 0.567 ' HB2' HG22 ' A' ' 103' ' ' ILE . 54.4 Cg_endo -69.71 151.21 69.3 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.724 2.283 . . . . 73.11 112.311 179.832 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -52.96 -26.29 14.68 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.196 -0.457 . . . . 74.11 110.814 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.567 HG22 ' HB2' ' A' ' 101' ' ' PRO . 5.5 tt -77.1 -39.51 29.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.312 -0.403 . . . . 74.02 111.124 179.9 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 104' ' ' THR . . . . . 0.785 ' O ' HD22 ' A' ' 108' ' ' LEU . 3.4 m -69.12 -36.79 77.87 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.241 -0.436 . . . . 52.11 111.177 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.8 HG13 ' CZ ' ' A' ' 188' ' ' PHE . 57.5 t -71.27 -42.15 74.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.172 -0.467 . . . . 71.51 111.165 179.853 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.645 ' O ' HG22 ' A' ' 109' ' ' VAL . 22.9 t0 -68.66 -38.21 80.25 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.217 -0.447 . . . . 63.44 110.928 179.888 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 107' ' ' ARG . . . . . 0.483 ' HG3' ' N ' ' A' ' 108' ' ' LEU . 0.0 OUTLIER -70.0 -33.49 72.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.153 -0.476 . . . . 75.02 110.869 -179.869 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.785 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -64.64 -47.76 77.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.188 -0.46 . . . . 71.04 110.993 179.929 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.748 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.3 m -55.16 -41.32 59.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 72.31 111.201 179.797 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.464 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 44.8 t -70.0 -34.67 73.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.174 -0.466 . . . . 72.14 110.892 -179.906 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.451 ' CG ' HD21 ' A' ' 189' ' ' LEU . 0.3 OUTLIER -63.46 -34.64 78.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.11 -0.496 . . . . 74.35 110.887 179.948 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -92.27 -40.42 10.96 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.233 -0.44 . . . . 74.32 111.069 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 1.055 HD13 HD12 ' A' ' 196' ' ' LEU . 9.2 tp -64.4 -32.59 74.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.224 -0.444 . . . . 72.0 110.977 179.974 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 39.7 t30 -66.66 -38.77 87.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.209 -0.45 . . . . 72.34 110.886 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' MET . . . . . 0.734 ' O ' HD11 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -60.84 -34.7 74.97 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.167 -0.469 . . . . 54.12 110.906 179.906 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 116' ' ' TRP . . . . . 0.407 ' O ' HG12 ' A' ' 120' ' ' ILE . 8.7 m95 -68.52 -38.81 81.22 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.186 -0.461 . . . . 75.23 110.872 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 117' ' ' GLY . . . . . 0.451 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -73.64 -33.91 57.48 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.76 -0.733 . . . . 73.32 112.456 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.7 -15.04 57.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.722 0.296 . . . . 72.42 110.863 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.807 ' HB2' HG23 ' A' ' 231' ' ' ILE . 5.1 pt-20 -106.25 13.56 28.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.264 -0.426 . . . . 75.24 110.954 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 0.998 HD12 HD12 ' A' ' 122' ' ' LEU . 7.3 pt -149.79 142.48 15.83 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.635 0.731 . . . . 71.34 111.157 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -69.86 25.32 0.18 Allowed 'Trans proline' 0 C--O 1.232 0.201 0 C-N-CA 122.641 2.228 . . . . 72.21 112.321 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.998 HD12 HD12 ' A' ' 120' ' ' ILE . 14.3 mt -81.49 -159.42 0.27 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.206 -0.452 . . . . 73.22 110.934 179.97 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 123' ' ' HIS . . . . . 0.456 ' H ' ' HB3' ' A' ' 122' ' ' LEU . 27.6 t-80 -157.25 137.26 12.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.237 -0.438 . . . . 74.12 110.929 179.857 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 124' ' ' PHE . . . . . 0.411 ' CE2' ' HA3' ' A' ' 117' ' ' GLY . 20.9 m-85 -117.68 138.23 52.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.197 -0.456 . . . . 75.54 110.931 -179.897 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -118.27 141.48 48.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.149 -0.478 . . . . 75.14 110.821 -179.815 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.55 154.63 27.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.171 -0.468 . . . . 72.22 110.915 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 127' ' ' VAL . . . . . 0.718 HG11 ' HB2' ' A' ' 132' ' ' ALA . 19.5 m -103.38 126.91 57.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.189 -0.46 . . . . 50.13 111.132 179.894 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.427 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -145.13 -25.99 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.208 -0.451 . . . . 74.43 111.152 179.901 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 129' ' ' TRP . . . . . 0.427 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -139.76 109.27 6.22 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.176 -0.465 . . . . 71.25 110.877 179.954 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 103.0 -167.48 17.17 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.682 -0.77 . . . . 62.11 112.469 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -101.76 156.15 17.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.741 0.305 . . . . 63.25 111.158 -179.842 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 132' ' ' ALA . . . . . 0.718 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -111.72 165.29 12.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.246 -0.433 . . . . 51.34 111.135 179.858 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -74.45 -44.57 51.12 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.242 -0.436 . . . . 75.41 110.893 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 134' ' ' ILE . . . . . 0.606 HG23 ' O ' ' A' ' 168' ' ' GLY . 3.8 mm -89.39 113.3 25.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 70.51 111.172 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 135' ' ' MET . . . . . 0.456 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 8.4 mmm -101.82 122.59 44.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.177 -0.465 . . . . 72.43 110.877 179.864 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -107.0 93.42 2.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 70.04 111.123 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -130.17 173.1 20.03 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.709 -0.757 . . . . 63.34 112.418 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 138' ' ' PHE . . . . . 0.553 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 51.4 m-85 -108.48 149.83 28.26 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.854 0.359 . . . . 74.01 110.904 -179.877 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.553 ' HB2' ' O ' ' A' ' 138' ' ' PHE . . . 170.35 166.12 0.07 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.165 -0.47 . . . . 71.21 111.118 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.45 ' HB2' ' CB ' ' A' ' 149' ' ' PHE . 1.9 ptt180 -109.59 174.14 6.0 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.234 -0.439 . . . . 62.21 110.908 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 141' ' ' GLY . . . . . 0.452 ' H ' ' HA ' ' A' ' 149' ' ' PHE . . . -55.34 -18.93 15.53 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.676 -0.773 . . . . 74.24 112.53 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 142' ' ' ALA . . . . . 0.461 ' HB2' ' HD2' ' A' ' 149' ' ' PHE . . . -91.43 13.18 18.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.793 0.33 . . . . 75.03 111.082 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 143' ' ' HIS . . . . . 0.517 ' HB3' ' HB1' ' A' ' 139' ' ' ALA . 2.2 p80 -77.91 -15.75 58.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.212 -0.449 . . . . 71.11 110.855 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 128.27 49.62 0.15 Allowed Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.74 -0.743 . . . . 45.51 112.492 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -153.26 169.55 22.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.827 0.346 . . . . 72.14 110.863 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.38 165.47 11.81 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.216 -0.447 . . . . 51.25 110.902 -179.799 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 12.6 m-85 64.75 134.07 0.04 OUTLIER Pre-proline 0 C--N 1.327 -0.377 0 CA-C-O 121.724 0.773 . . . . 73.4 110.919 -179.843 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 151.35 68.85 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.674 2.249 . . . . 74.53 112.337 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 149' ' ' PHE . . . . . 0.461 ' HD2' ' HB2' ' A' ' 142' ' ' ALA . 10.4 p90 -53.19 -44.63 68.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.265 -0.425 . . . . 63.52 110.861 -179.979 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 75.52 -21.23 0.31 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.088 -0.506 . . . . 63.11 110.882 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 151' ' ' GLY . . . . . 0.45 ' H ' ' C ' ' A' ' 149' ' ' PHE . . . 68.04 -139.83 35.06 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.726 -0.749 . . . . 71.41 112.434 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.69 142.43 48.2 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.647 2.231 . . . . 75.11 112.357 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 153' ' ' GLY . . . . . 0.449 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 104.38 -143.47 15.69 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.768 -0.73 . . . . 70.32 112.437 179.918 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 154' ' ' ASN . . . . . 0.449 ' C ' ' O ' ' A' ' 153' ' ' GLY . 4.1 p30 -34.52 141.23 0.06 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.922 0.392 . . . . 73.25 110.867 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 75.72 117.88 0.06 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.126 -0.488 . . . . 44.41 111.098 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 156' ' ' LEU . . . . . 1.047 HD21 HG21 ' A' ' 186' ' ' ILE . 1.2 tp -107.07 -51.8 2.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.464 . . . . 75.02 110.955 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 157' ' ' ALA . . . . . 0.554 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -154.67 149.58 26.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.209 -0.45 . . . . 71.42 111.025 179.787 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 29.3 p-80 -116.39 110.94 19.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.172 -0.467 . . . . 72.02 110.816 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -110.95 170.3 8.19 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.313 -0.403 . . . . 74.42 111.118 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -146.65 164.35 32.94 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.208 -0.451 . . . . 75.31 110.868 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 161' ' ' ALA . . . . . 0.729 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -93.74 164.99 18.96 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.498 0.666 . . . . 61.04 111.16 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 162' ' ' PRO . . . . . 0.729 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 54.1 Cg_endo -69.76 77.23 1.08 Allowed 'Trans proline' 0 C--O 1.231 0.169 0 C-N-CA 122.726 2.284 . . . . 74.44 112.35 -179.942 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -112.41 120.42 5.29 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.741 -0.742 . . . . 61.41 112.457 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 1.2 m 76.17 -58.97 0.52 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.789 0.328 . . . . 73.1 111.148 -179.827 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . 172.1 -56.49 0.17 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.784 -0.722 . . . . 74.03 112.483 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 166' ' ' LEU . . . . . 0.461 HD23 ' O ' ' A' ' 166' ' ' LEU . 1.3 tt -60.81 -18.08 53.37 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.83 0.348 . . . . 65.12 110.925 -179.926 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -71.03 176.91 36.25 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.757 -0.735 . . . . 43.43 112.494 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 168' ' ' GLY . . . . . 0.606 ' O ' HG23 ' A' ' 134' ' ' ILE . . . 76.47 13.63 83.22 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.711 -0.757 . . . . 74.31 112.536 -179.88 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -94.05 149.69 21.01 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.822 0.344 . . . . 63.41 110.887 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.33 130.9 55.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.249 -0.432 . . . . 74.21 111.148 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 171' ' ' HIS . . . . . 0.448 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 62.9 m170 -128.05 132.75 49.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.218 -0.446 . . . . 72.53 110.906 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 30.3 m-85 -112.04 139.2 47.75 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.216 -0.447 . . . . 71.44 110.919 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -70.22 99.74 1.57 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.206 -0.452 . . . . 74.11 110.869 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.78 -16.67 12.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.231 -0.441 . . . . 72.25 110.893 -179.896 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 -76.25 -16.07 59.88 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.182 -0.463 . . . . 73.32 110.859 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -87.95 -176.22 5.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 63.2 110.88 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 48.0 mtm180 -110.83 119.74 40.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.158 -0.474 . . . . 63.14 110.93 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 48.9 m95 -117.04 139.16 51.03 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.256 -0.429 . . . . 72.31 110.934 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 179' ' ' THR . . . . . 0.617 ' HA ' HD11 ' A' ' 100' ' ' LEU . 7.1 t -177.33 163.51 2.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.267 -0.424 . . . . 74.13 111.151 -179.924 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -125.65 -68.55 0.83 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.233 -0.44 . . . . 45.33 110.916 179.895 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -65.26 -11.16 51.34 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.745 -0.74 . . . . 62.41 112.416 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 182' ' ' SER . . . . . 0.46 ' HB2' HG21 ' A' ' 179' ' ' THR . 1.5 m -97.34 -24.42 15.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.833 0.349 . . . . 64.5 110.907 -179.831 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 183' ' ' SER . . . . . 0.438 ' C ' ' O ' ' A' ' 182' ' ' SER . 12.1 m 34.82 61.76 0.57 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.147 -0.479 . . . . 64.12 110.88 -179.824 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -116.9 -33.59 4.71 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.067 -0.515 . . . . 74.2 110.942 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -122.3 -136.38 4.9 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.671 -0.776 . . . . 73.01 112.442 179.893 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 186' ' ' ILE . . . . . 1.047 HG21 HD21 ' A' ' 156' ' ' LEU . 8.2 mm -79.41 99.53 3.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.814 0.34 . . . . 73.22 111.138 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -50.29 121.79 6.06 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.18 -0.464 . . . . 71.31 110.844 -179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 188' ' ' PHE . . . . . 0.8 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.7 t80 -53.85 -34.84 60.54 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.207 -0.451 . . . . 75.45 110.905 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 189' ' ' LEU . . . . . 0.451 HD21 ' CG ' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -67.25 -47.46 70.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 52.02 110.905 -179.966 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 13.1 m-30 -69.47 -41.44 76.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.226 -0.443 . . . . 74.22 110.893 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 191' ' ' ALA . . . . . 0.611 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -68.38 -35.91 78.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.177 -0.465 . . . . 50.03 111.094 179.846 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 192' ' ' ALA . . . . . 0.66 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -58.56 -44.61 89.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.199 -0.455 . . . . 52.11 111.125 179.919 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 193' ' ' THR . . . . . 0.5 HG21 HG21 ' A' ' 211' ' ' VAL . 0.9 OUTLIER -58.24 -42.9 87.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.152 -0.476 . . . . 72.43 111.178 -179.904 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 8.0 t-160 -72.84 -41.64 64.59 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.215 -0.448 . . . . 71.44 110.876 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -71.44 -47.92 52.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 71.01 111.095 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 196' ' ' LEU . . . . . 1.055 HD12 HD13 ' A' ' 113' ' ' LEU . 4.4 mm? -63.82 -44.34 93.54 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.312 -0.404 . . . . 74.51 110.955 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -58.85 -27.47 61.94 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.698 -0.763 . . . . 52.23 112.552 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 198' ' ' HIS . . . . . 0.407 ' CD2' HG21 ' A' ' 69' ' ' VAL . 4.9 m-70 -67.38 -43.79 80.52 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.778 0.323 . . . . 75.21 110.909 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.15 -26.33 64.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.232 -0.44 . . . . 71.13 110.855 -179.794 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -83.98 2.96 36.38 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.138 -0.483 . . . . 64.13 110.926 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 83.52 -8.04 66.55 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.759 -0.734 . . . . 50.41 112.469 179.904 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 202' ' ' MET . . . . . 0.555 ' SD ' HD12 ' A' ' 234' ' ' ILE . 0.0 OUTLIER -49.84 134.84 20.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.833 0.349 . . . . 63.21 110.85 -179.975 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -102.66 159.1 17.72 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.727 -0.749 . . . . 64.44 112.468 -179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 29.2 m-70 -58.7 158.26 8.21 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.786 0.327 . . . . 74.32 110.899 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -124.09 138.97 54.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.253 -0.43 . . . . 53.34 110.939 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 206' ' ' SER . . . . . 0.402 ' HB2' ' HA3' ' A' ' 47' ' ' GLY . 3.1 p -76.79 -4.46 43.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.131 -0.486 . . . . 72.22 110.829 -179.742 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.71 135.09 83.58 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.624 0.726 . . . . 65.11 110.899 179.904 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.72 -6.3 18.26 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.709 2.273 . . . . 74.53 112.328 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -123.1 22.89 9.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.222 -0.444 . . . . 63.52 110.942 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 210' ' ' ALA . . . . . 0.494 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.13 145.63 26.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.15 -0.477 . . . . 62.23 111.144 179.851 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 211' ' ' VAL . . . . . 0.5 HG21 HG21 ' A' ' 193' ' ' THR . 0.4 OUTLIER -69.56 -28.05 36.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.261 -0.427 . . . . 62.04 111.06 -179.987 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 8.5 mmm -95.4 12.91 27.59 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.197 -0.456 . . . . 75.22 110.871 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 213' ' ' TYR . . . . . 0.417 ' CE2' ' HB ' ' A' ' 215' ' ' THR . 1.9 t80 -54.88 112.29 3.9 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-O 121.672 0.748 . . . . 73.43 110.898 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 214' ' ' PRO . . . . . 0.415 ' HD2' ' HA ' ' A' ' 213' ' ' TYR . 53.9 Cg_endo -69.82 -17.62 37.18 Favored 'Trans proline' 0 C--O 1.233 0.234 0 C-N-CA 122.698 2.266 . . . . 63.01 112.285 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 215' ' ' THR . . . . . 0.653 HG23 HG21 ' A' ' 61' ' ' ILE . 0.2 OUTLIER -83.48 59.53 5.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.29 -0.414 . . . . 74.24 111.127 -179.956 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.223 -0.444 . . . . 74.14 110.861 -179.906 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.526 0.055 0 CA-C-O 120.993 0.425 . . . . 65.01 110.823 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.92 163.43 32.82 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.08 -0.509 . . . . 64.24 110.851 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 226' ' ' LEU . . . . . 0.734 HD11 ' O ' ' A' ' 115' ' ' MET . 11.5 mt -60.75 148.98 37.06 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.199 -0.455 . . . . 53.44 110.951 179.863 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 227' ' ' SER . . . . . 0.494 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 1.2 t -87.51 151.89 22.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.231 -0.441 . . . . 74.21 110.804 -179.882 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 19.7 tt0 -62.34 -66.07 0.59 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.146 -0.479 . . . . 74.54 110.809 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -55.55 -26.19 41.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.191 -0.459 . . . . 72.22 110.885 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -69.15 -48.12 63.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.179 -0.464 . . . . 74.23 110.867 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 231' ' ' ILE . . . . . 0.807 HG23 ' HB2' ' A' ' 119' ' ' GLU . 7.9 mt -68.3 -43.21 84.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.197 -0.456 . . . . 73.41 111.059 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 2.0 pttp -62.84 -31.85 72.95 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.232 -0.44 . . . . 65.42 110.915 179.84 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -62.62 -49.95 68.68 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.813 -0.708 . . . . 63.43 112.473 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 234' ' ' ILE . . . . . 0.555 HD12 ' SD ' ' A' ' 202' ' ' MET . 6.7 tt -73.07 -30.83 32.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.865 0.364 . . . . 71.54 111.174 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -68.67 -24.03 64.47 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.123 -0.489 . . . . 70.33 110.977 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 236' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.76 -28.17 60.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.126 -0.488 . . . . 51.21 110.915 179.911 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 237' ' ' LEU . . . . . 0.821 HD22 ' HD2' ' A' ' 83' ' ' LYS . 10.3 tt -98.02 -29.36 13.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.149 -0.478 . . . . 75.41 110.889 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 238' ' ' TYR . . . . . 0.492 ' CE2' HD11 ' A' ' 122' ' ' LEU . 27.9 m-85 -91.99 -35.46 13.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.245 -0.434 . . . . 51.24 110.916 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.388 0 C-N-CA 120.784 -0.722 . . . . 32.22 112.479 179.962 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 19.4 t-105 . . . . . 0 C--O 1.23 0.071 0 CA-C-O 120.741 0.305 . . . . 71.22 110.886 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -72.26 -42.2 65.89 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.19 -0.459 . . . . 72.51 110.892 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -63.54 -36.85 85.15 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.156 -0.475 . . . . 61.24 110.944 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.19 -34.85 68.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.113 -0.494 . . . . 54.34 111.104 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -69.88 -37.83 76.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.242 -0.435 . . . . 73.12 110.987 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.406 ' HA ' ' HD2' ' A' ' 20' ' ' LYS . 1.9 m-20 -77.47 -31.56 53.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.179 -0.464 . . . . 72.4 110.811 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 4.0 m-30 -59.79 -36.09 75.99 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.212 -0.449 . . . . 75.11 110.897 -179.794 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.656 HD13 ' O ' ' A' ' 19' ' ' LEU . 2.9 tm? -72.11 -21.01 61.54 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.146 -0.479 . . . . 72.51 110.876 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.406 ' HD2' ' HA ' ' A' ' 17' ' ' ASP . 1.4 ptmt -77.62 -26.56 50.65 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.219 -0.446 . . . . 74.41 110.901 179.84 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.425 ' HG3' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -83.83 -27.85 28.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.444 . . . . 74.05 110.871 -179.989 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.425 ' N ' ' HG3' ' A' ' 21' ' ' ARG . 2.7 m-85 -60.79 -22.36 64.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.196 -0.456 . . . . 74.31 110.868 -179.898 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 . . . . . 0 C--N 1.328 -0.35 0 CA-C-N 116.206 -0.452 . . . . 72.55 110.899 -179.845 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.525 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 1.8 mm? . . . . . 0 C--O 1.23 0.062 0 CA-C-O 120.782 0.325 . . . . 72.52 110.922 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.64 -50.87 71.73 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.211 -0.449 . . . . 73.13 110.943 179.858 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.56 -36.76 84.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.122 -0.49 . . . . 63.32 111.103 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.494 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.7 OUTLIER -68.66 -49.75 56.62 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.181 -0.463 . . . . 72.32 110.865 -179.995 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' A' ' 35' ' ' LEU . 7.0 mt -56.44 -36.89 69.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.28 -0.418 . . . . 72.11 110.919 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.9 mttt -58.52 -45.56 88.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.146 -0.479 . . . . 62.43 110.878 179.856 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.494 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 2.3 pt-20 -60.43 -32.58 71.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.254 -0.43 . . . . 75.11 110.919 179.931 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.3 tmt? -68.25 -34.36 76.05 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.12 -0.491 . . . . 63.43 110.914 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.784 ' OE1' HD11 ' A' ' 48' ' ' LEU . 6.8 mm-40 -57.14 -39.64 75.6 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.265 -0.425 . . . . 74.45 110.952 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.4 mmpt? -69.9 -28.27 65.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.137 -0.483 . . . . 71.43 110.947 179.9 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 43.6 t80 -70.37 -37.56 74.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.175 -0.466 . . . . 73.32 110.895 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.722 ' HB3' HD23 ' A' ' 48' ' ' LEU . 3.0 m-85 -81.84 -35.04 29.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.158 -0.474 . . . . 70.43 110.898 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.42 ' HA2' ' HB3' ' A' ' 206' ' ' SER . . . 106.06 -10.27 43.84 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.804 -0.712 . . . . 64.34 112.478 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.784 HD11 ' OE1' ' A' ' 43' ' ' GLN . 0.8 OUTLIER -65.68 139.11 96.91 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.603 0.716 . . . . 64.11 110.931 -179.937 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.462 ' HG2' HD13 ' A' ' 50' ' ' ILE . 54.4 Cg_endo -69.72 -51.98 0.36 Allowed 'Trans proline' 0 C--O 1.232 0.22 0 C-N-CA 122.67 2.246 . . . . 74.5 112.329 179.833 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.488 ' O ' HD12 ' A' ' 48' ' ' LEU . 0.0 OUTLIER -53.01 108.15 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.223 -0.444 . . . . 71.22 111.133 179.962 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.404 ' HA ' ' HG3' ' A' ' 43' ' ' GLN . 3.7 t -119.75 155.96 31.47 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.178 -0.465 . . . . 73.25 111.109 179.984 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.54 -7.58 57.39 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.774 -0.727 . . . . 64.24 112.435 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 15.3 mtt -135.1 161.17 36.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.789 0.328 . . . . 75.23 110.853 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.422 ' HA ' ' HB ' ' A' ' 58' ' ' VAL . 2.8 pp -156.59 128.97 7.53 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.169 -0.469 . . . . 73.4 110.941 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 176.2 -30.31 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 44.35 110.852 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 20.4 p -93.51 -88.48 0.23 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.218 -0.446 . . . . 75.25 110.821 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 2.9 mmm180 -84.71 -35.55 22.44 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.131 -0.486 . . . . 61.22 110.832 -179.889 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.422 ' HB ' ' HA ' ' A' ' 54' ' ' LEU . 16.6 t -60.64 -43.71 95.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.169 -0.469 . . . . 70.12 111.122 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -74.82 -31.25 25.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.244 -0.434 . . . . 74.43 111.155 179.951 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -67.17 -44.13 80.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.132 -0.485 . . . . 73.45 110.982 179.87 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.562 HD12 ' CZ ' ' A' ' 46' ' ' PHE . 37.3 pt -66.89 -30.06 48.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.184 -0.462 . . . . 74.52 111.107 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -58.47 -40.67 83.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.181 -0.463 . . . . 74.01 110.893 179.888 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 16.0 pt20 -91.66 -23.94 19.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.29 -0.414 . . . . 42.22 110.905 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 4.2 ttmm -78.8 114.43 43.79 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.549 0.69 . . . . 65.34 110.906 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.85 140.22 41.82 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.668 2.246 . . . . 72.11 112.268 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.561 ' O ' HD23 ' A' ' 156' ' ' LEU . 1.0 OUTLIER -140.78 -61.69 0.49 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.157 -0.474 . . . . 71.51 110.873 -179.961 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -145.46 151.17 37.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.157 -0.474 . . . . 55.3 110.848 -179.93 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.545 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -109.51 24.27 20.46 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.677 -0.773 . . . . 64.23 112.437 -179.943 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.616 HG12 ' HD2' ' A' ' 70' ' ' PRO . 0.2 OUTLIER -103.17 137.51 19.28 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.527 0.68 . . . . 74.23 111.177 -179.978 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 70' ' ' PRO . . . . . 0.616 ' HD2' HG12 ' A' ' 69' ' ' VAL . 53.9 Cg_endo -69.69 141.92 46.84 Favored 'Trans proline' 0 N--CA 1.465 -0.152 0 C-N-CA 122.721 2.281 . . . . 63.44 112.33 179.948 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -94.78 22.67 6.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.47 . . . . 74.45 110.908 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.141 -0.481 . . . . 53.43 111.092 179.999 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.401 ' HB2' ' HD3' ' A' ' 83' ' ' LYS . 53.9 Cg_endo . . . . . 0 C--O 1.231 0.175 0 CA-C-O 120.898 0.291 . . . . 71.11 112.302 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.742 ' CD ' HD22 ' A' ' 237' ' ' LEU . 0.0 OUTLIER -132.38 -172.18 2.83 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.182 -0.463 . . . . 64.45 110.909 179.931 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 84' ' ' TRP . . . . . 0.428 ' CE2' ' HB3' ' A' ' 162' ' ' PRO . 61.0 m95 -64.68 140.32 58.86 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.255 -0.43 . . . . 73.31 110.915 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.15 -2.29 12.78 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.236 -0.438 . . . . 65.3 111.184 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.6 m -72.52 -178.87 2.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.134 -0.485 . . . . 70.34 110.872 -179.883 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.92 -15.98 18.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.121 -0.49 . . . . 71.12 110.882 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -155.67 143.37 11.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.243 -0.435 . . . . 74.14 111.176 179.871 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 6.5 t -118.92 130.26 73.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.2 -0.455 . . . . 72.25 111.132 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.63 HG22 ' HB3' ' A' ' 125' ' ' ARG . 21.9 p -119.88 165.92 13.98 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.161 -0.472 . . . . 71.01 111.149 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 3.1 p90 -151.45 146.48 25.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.211 -0.449 . . . . 70.51 110.901 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 4.0 ttt180 -149.17 131.68 15.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.142 -0.481 . . . . 71.25 110.852 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.562 HG23 ' O ' ' A' ' 136' ' ' ILE . 5.0 mp -75.27 132.87 32.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.132 -0.485 . . . . 72.4 111.162 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.431 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 22.0 t -84.99 -40.29 14.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.166 -0.47 . . . . 60.2 111.111 179.897 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 84.5 p -159.15 169.41 24.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.15 -0.477 . . . . 64.24 110.889 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 12.6 p90 -123.61 155.15 38.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.126 -0.488 . . . . 72.25 110.932 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 5.3 t -94.12 141.19 28.83 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.144 -0.48 . . . . 64.11 111.16 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.7 -18.7 1.94 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.236 -0.438 . . . . 72.14 110.894 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.25 -36.93 85.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.169 -0.468 . . . . 74.13 110.818 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.704 HD22 HG21 ' A' ' 104' ' ' THR . 1.2 mt -140.15 153.47 69.16 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.54 0.686 . . . . 72.52 110.952 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 101' ' ' PRO . . . . . 0.567 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.4 Cg_endo -69.81 150.98 68.63 Favored 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.629 2.219 . . . . 73.11 112.324 179.887 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 12.7 t-160 -52.22 -27.89 16.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.164 -0.471 . . . . 74.11 110.919 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.567 HG22 ' HB2' ' A' ' 101' ' ' PRO . 0.0 OUTLIER -75.03 -39.17 43.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.218 -0.446 . . . . 74.02 111.126 -179.992 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 104' ' ' THR . . . . . 0.704 HG21 HD22 ' A' ' 100' ' ' LEU . 3.0 m -69.66 -39.11 77.25 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.157 -0.474 . . . . 52.11 111.14 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.777 ' O ' HG13 ' A' ' 109' ' ' VAL . 76.5 t -72.83 -46.22 53.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.187 -0.461 . . . . 71.51 111.11 179.93 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.683 ' O ' HG22 ' A' ' 109' ' ' VAL . 0.3 OUTLIER -60.74 -44.17 97.01 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.147 -0.479 . . . . 63.44 110.814 179.987 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 11.2 ptm180 -70.16 -34.11 72.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.198 -0.456 . . . . 75.02 110.838 -179.856 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.647 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -61.15 -48.26 82.4 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.17 -0.468 . . . . 71.04 110.877 -179.968 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.777 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.5 m -55.4 -41.61 63.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.244 -0.435 . . . . 72.31 111.087 179.846 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.469 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 10.7 t -70.11 -33.51 71.93 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.16 -0.473 . . . . 72.14 110.878 -179.847 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.43 ' HB3' HD21 ' A' ' 189' ' ' LEU . 0.4 OUTLIER -61.47 -32.86 72.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.105 -0.498 . . . . 74.35 110.957 179.931 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -97.14 -40.47 8.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.196 -0.457 . . . . 74.32 111.144 179.783 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.712 HD12 HD12 ' A' ' 196' ' ' LEU . 0.4 OUTLIER -65.38 -33.88 77.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.206 -0.452 . . . . 72.0 110.956 -180.0 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 36.7 t-20 -67.55 -35.71 79.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.177 -0.465 . . . . 72.34 110.812 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 115' ' ' MET . . . . . 0.908 ' HB3' HD23 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -68.25 -33.6 74.67 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.226 -0.443 . . . . 54.12 110.89 179.888 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 6.0 m95 -68.55 -44.91 73.51 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.225 -0.443 . . . . 75.23 110.966 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -73.38 -40.43 48.45 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.695 -0.764 . . . . 73.32 112.532 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.416 ' HG2' ' O ' ' A' ' 115' ' ' MET . 4.5 ptpt -60.76 -16.93 45.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.709 0.29 . . . . 72.42 110.897 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.667 ' HB3' HG23 ' A' ' 231' ' ' ILE . 27.9 mm-40 -98.26 13.51 31.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.205 -0.452 . . . . 75.24 110.902 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 0.988 HD12 HD12 ' A' ' 122' ' ' LEU . 6.1 pt -147.64 150.31 36.31 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.561 0.696 . . . . 71.34 111.162 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.85 6.75 1.22 Allowed 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.662 2.242 . . . . 72.21 112.326 179.901 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.988 HD12 HD12 ' A' ' 120' ' ' ILE . 10.2 mt -60.2 -160.37 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.259 -0.428 . . . . 73.22 110.882 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 4.6 t-80 -154.31 121.29 5.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.199 -0.455 . . . . 74.12 110.848 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 10.0 m-30 -109.33 148.74 30.55 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.173 -0.467 . . . . 75.54 110.899 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.63 ' HB3' HG22 ' A' ' 90' ' ' THR . 0.1 OUTLIER -130.69 141.73 50.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.146 -0.479 . . . . 75.14 110.827 -179.884 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 126' ' ' LYS . . . . . 0.522 ' HE3' HG13 ' A' ' 128' ' ' VAL . 0.1 OUTLIER -80.93 147.5 30.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.148 -0.478 . . . . 72.22 110.911 179.928 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 127' ' ' VAL . . . . . 1.048 HG11 ' HB2' ' A' ' 132' ' ' ALA . 29.9 m -103.08 126.3 57.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.258 -0.428 . . . . 50.13 111.145 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.602 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -142.45 -10.3 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.12 -0.491 . . . . 74.43 111.17 179.854 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 129' ' ' TRP . . . . . 0.602 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -154.87 109.17 2.96 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.132 -0.486 . . . . 71.25 110.905 179.979 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.68 -159.72 14.33 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.722 -0.752 . . . . 62.11 112.457 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.3 p -101.82 156.33 17.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.852 0.358 . . . . 63.25 111.11 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 132' ' ' ALA . . . . . 1.048 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -111.61 165.26 12.17 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.176 -0.465 . . . . 51.34 111.053 179.915 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.06 -62.54 1.36 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.225 -0.443 . . . . 75.41 110.817 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 134' ' ' ILE . . . . . 0.435 HD12 ' O ' ' A' ' 90' ' ' THR . 4.6 mp -88.68 122.53 40.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 70.51 111.167 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 135' ' ' MET . . . . . 0.431 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 14.3 mmm -100.58 125.79 46.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.149 -0.478 . . . . 72.43 110.829 179.882 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.562 ' O ' HG23 ' A' ' 93' ' ' ILE . 0.9 OUTLIER -105.92 94.97 3.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.165 -0.47 . . . . 70.04 111.113 179.989 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -129.7 167.71 21.43 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.742 -0.742 . . . . 63.34 112.462 179.922 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 138' ' ' PHE . . . . . 0.563 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 55.3 m-85 -105.1 145.47 30.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.849 0.357 . . . . 74.01 110.913 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.563 ' HB2' ' O ' ' A' ' 138' ' ' PHE . . . 169.72 166.11 0.05 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.12 -0.491 . . . . 71.21 111.102 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.434 ' HB2' ' HB3' ' A' ' 149' ' ' PHE . 0.0 OUTLIER -107.94 174.21 5.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.262 -0.426 . . . . 62.21 110.819 -179.926 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 141' ' ' GLY . . . . . 0.555 ' H ' ' HA ' ' A' ' 149' ' ' PHE . . . -55.67 -16.44 11.44 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.753 -0.737 . . . . 74.24 112.471 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 142' ' ' ALA . . . . . 0.531 ' HB2' ' HD2' ' A' ' 149' ' ' PHE . . . -94.12 13.12 24.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.828 0.347 . . . . 75.03 111.113 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 143' ' ' HIS . . . . . 0.556 ' CB ' ' HB1' ' A' ' 139' ' ' ALA . 3.2 p80 -79.42 -4.48 51.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.202 -0.453 . . . . 71.11 110.867 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 110.77 48.13 0.75 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.69 -0.767 . . . . 45.51 112.46 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -161.79 175.11 12.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.9 0.381 . . . . 72.14 110.818 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 69.9 p -63.81 175.22 1.19 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.154 -0.476 . . . . 51.25 110.862 -179.762 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 64.52 118.93 0.02 OUTLIER Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.743 0.782 . . . . 73.4 110.876 -179.882 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.72 151.18 69.26 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.654 2.236 . . . . 74.53 112.325 179.901 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 149' ' ' PHE . . . . . 0.555 ' HA ' ' H ' ' A' ' 141' ' ' GLY . 3.6 p90 -54.23 -38.38 65.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.231 -0.44 . . . . 63.52 110.844 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 150' ' ' ASP . . . . . 0.492 ' CG ' ' O ' ' A' ' 149' ' ' PHE . 2.7 p30 48.72 18.46 0.19 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.166 -0.47 . . . . 63.11 110.858 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 151' ' ' GLY . . . . . 0.42 ' C ' ' O ' ' A' ' 150' ' ' ASP . . . 36.44 -150.29 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.767 -0.73 . . . . 71.41 112.434 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.72 144.66 54.93 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.709 2.273 . . . . 75.11 112.289 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 153' ' ' GLY . . . . . 0.449 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 106.04 -138.14 14.18 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.737 -0.744 . . . . 70.32 112.447 179.904 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 154' ' ' ASN . . . . . 0.449 ' C ' ' O ' ' A' ' 153' ' ' GLY . 3.6 p30 -34.2 136.37 0.13 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.882 0.373 . . . . 73.25 110.881 -179.856 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 155' ' ' THR . . . . . 0.419 HG22 ' HA3' ' A' ' 68' ' ' GLY . 0.2 OUTLIER 75.56 110.56 0.07 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.185 -0.461 . . . . 44.41 111.15 179.992 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 156' ' ' LEU . . . . . 0.932 HD21 HG21 ' A' ' 186' ' ' ILE . 0.4 OUTLIER -91.17 -54.32 3.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.222 -0.445 . . . . 75.02 110.896 -179.979 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 157' ' ' ALA . . . . . 0.545 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -163.85 148.95 10.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.22 -0.446 . . . . 71.42 111.022 179.794 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 158' ' ' HIS . . . . . 0.415 ' O ' ' HB2' ' A' ' 171' ' ' HIS . 14.5 p-80 -107.54 125.38 51.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.155 -0.475 . . . . 72.02 110.908 179.943 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -110.54 155.09 22.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.229 -0.441 . . . . 74.42 111.1 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 16.7 m-85 -106.86 151.95 24.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.246 -0.434 . . . . 75.31 110.867 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 161' ' ' ALA . . . . . 0.713 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -78.52 164.75 54.29 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.626 0.727 . . . . 61.04 111.046 179.925 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 162' ' ' PRO . . . . . 0.713 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.2 Cg_endo -69.83 78.48 1.03 Allowed 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.688 2.259 . . . . 74.44 112.257 -179.956 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -130.45 119.87 2.87 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.73 -0.748 . . . . 61.41 112.422 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 50.85 -169.86 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.874 0.369 . . . . 73.1 111.101 -179.896 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -75.51 -54.57 5.45 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.752 -0.737 . . . . 74.03 112.508 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 166' ' ' LEU . . . . . 0.438 ' C ' HD23 ' A' ' 166' ' ' LEU . 10.1 tt -54.36 -40.15 67.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.863 0.364 . . . . 65.12 110.895 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -80.22 164.04 47.47 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.742 -0.742 . . . . 43.43 112.512 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 168' ' ' GLY . . . . . 0.403 ' O ' HG13 ' A' ' 134' ' ' ILE . . . 84.54 23.11 51.88 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.815 -0.707 . . . . 74.31 112.515 -179.85 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -91.3 163.52 14.19 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.736 0.303 . . . . 63.41 110.89 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.49 130.95 55.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.225 -0.443 . . . . 74.21 111.061 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 171' ' ' HIS . . . . . 0.415 ' HB2' ' O ' ' A' ' 158' ' ' HIS . 27.3 m170 -125.1 158.55 33.58 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 72.53 110.831 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 64.0 m-85 -142.26 137.37 30.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.251 -0.432 . . . . 71.44 110.904 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 55.2 t0 -69.08 99.23 1.07 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 74.11 110.82 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.58 -16.41 10.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.152 -0.476 . . . . 72.25 110.879 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -77.86 -16.32 58.37 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.163 -0.472 . . . . 73.32 110.783 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 23.6 mm-40 -83.38 -175.65 5.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.241 -0.436 . . . . 63.2 110.898 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 1.9 mtt180 -109.8 116.79 32.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.143 -0.481 . . . . 63.14 110.917 -179.888 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 51.0 m95 -116.61 141.18 48.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.253 -0.43 . . . . 72.31 110.919 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 179' ' ' THR . . . . . 0.645 ' HA ' HD11 ' A' ' 100' ' ' LEU . 2.0 t -177.61 164.36 2.02 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.19 -0.459 . . . . 74.13 111.129 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -124.59 -68.76 0.84 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.213 -0.449 . . . . 45.33 110.881 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -70.51 -10.88 67.54 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.712 -0.756 . . . . 62.41 112.501 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 182' ' ' SER . . . . . 0.483 ' O ' ' C ' ' A' ' 183' ' ' SER . 0.2 OUTLIER -97.01 -24.29 15.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.878 0.37 . . . . 64.5 110.84 -179.723 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 183' ' ' SER . . . . . 0.483 ' C ' ' O ' ' A' ' 182' ' ' SER . 7.4 p 31.84 71.56 0.08 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.172 -0.467 . . . . 64.12 110.854 -179.877 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 184' ' ' LEU . . . . . 0.42 HD23 ' CG2' ' A' ' 179' ' ' THR . 0.5 OUTLIER -117.09 -32.64 4.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.215 -0.448 . . . . 74.2 110.895 179.987 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -132.28 -127.23 2.8 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.812 -0.708 . . . . 73.01 112.529 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 186' ' ' ILE . . . . . 0.932 HG21 HD21 ' A' ' 156' ' ' LEU . 6.7 mm -79.53 99.81 3.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.823 0.344 . . . . 73.22 111.147 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -55.96 125.65 22.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.173 -0.467 . . . . 71.31 110.824 179.946 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 188' ' ' PHE . . . . . 0.722 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.1 t80 -53.85 -33.28 55.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.185 -0.461 . . . . 75.45 110.863 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 189' ' ' LEU . . . . . 0.43 HD21 ' HB3' ' A' ' 111' ' ' LYS . 0.2 OUTLIER -67.21 -47.62 70.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.193 -0.458 . . . . 52.02 110.907 -179.981 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 10.1 m-30 -69.98 -40.15 75.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.228 -0.442 . . . . 74.22 110.908 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 191' ' ' ALA . . . . . 0.568 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -70.22 -35.8 74.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.119 -0.491 . . . . 50.03 111.061 179.919 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 192' ' ' ALA . . . . . 0.714 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -56.93 -44.66 82.69 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.26 -0.427 . . . . 52.11 111.132 179.914 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.07 -41.51 83.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.207 -0.451 . . . . 72.43 111.164 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 5.0 t-160 -72.81 -41.73 64.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 71.44 110.844 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -71.56 -48.42 48.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.164 -0.471 . . . . 71.01 111.142 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 196' ' ' LEU . . . . . 0.714 HD23 ' O ' ' A' ' 192' ' ' ALA . 4.3 mm? -64.66 -42.02 95.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.232 -0.44 . . . . 74.51 110.885 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -60.11 -29.04 67.48 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.784 -0.722 . . . . 52.23 112.438 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 198' ' ' HIS . . . . . 0.61 ' CD2' HG21 ' A' ' 69' ' ' VAL . 6.1 m-70 -69.19 -33.95 74.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.876 0.37 . . . . 75.21 110.947 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -68.92 -21.37 64.22 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.179 -0.464 . . . . 71.13 110.818 -179.794 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 200' ' ' LEU . . . . . 0.418 ' HB2' ' HG2' ' A' ' 202' ' ' MET . 0.5 OUTLIER -88.0 -1.05 57.75 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.155 -0.475 . . . . 64.13 110.913 -179.974 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 84.3 8.97 82.75 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.721 -0.752 . . . . 50.41 112.501 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 202' ' ' MET . . . . . 0.657 ' SD ' HD12 ' A' ' 234' ' ' ILE . 97.3 mmm -71.19 159.27 34.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.885 0.374 . . . . 63.21 110.882 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -125.94 159.18 20.34 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.682 -0.77 . . . . 64.44 112.45 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 16.4 m-70 -50.67 161.05 0.37 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.842 0.354 . . . . 74.32 110.873 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -123.16 150.47 43.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.199 -0.455 . . . . 53.34 110.915 -179.832 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 206' ' ' SER . . . . . 0.42 ' HB3' ' HA2' ' A' ' 47' ' ' GLY . 0.9 OUTLIER -87.63 -4.67 58.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.154 -0.475 . . . . 72.22 110.864 -179.817 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.55 137.96 83.41 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 121.557 0.694 . . . . 65.11 110.859 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 -7.23 20.54 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.699 2.266 . . . . 74.53 112.317 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 -128.97 30.78 5.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.24 -0.436 . . . . 63.52 110.9 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -87.11 145.7 26.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.129 -0.487 . . . . 62.23 111.149 179.904 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -67.77 -27.72 39.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.231 -0.44 . . . . 62.04 111.109 -179.958 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 81.1 mtp -97.1 8.58 44.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.167 -0.47 . . . . 75.22 110.906 179.931 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 213' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -55.89 114.16 6.99 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.695 0.759 . . . . 73.43 110.913 -179.887 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -69.72 -17.95 37.49 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.658 2.239 . . . . 63.01 112.372 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 215' ' ' THR . . . . . 0.488 HG23 HG21 ' A' ' 61' ' ' ILE . 0.3 OUTLIER -83.98 60.22 5.72 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.2 -0.454 . . . . 74.24 111.103 -179.935 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.33 0 CA-C-O 120.968 0.413 . . . . 74.14 110.939 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 8.1 t80 . . . . . 0 C--O 1.232 0.162 0 CA-C-O 120.929 0.395 . . . . 65.01 110.861 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.3 -176.87 5.2 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.137 -0.483 . . . . 64.24 110.84 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 226' ' ' LEU . . . . . 0.908 HD23 ' HB3' ' A' ' 115' ' ' MET . 0.7 OUTLIER -59.7 149.12 31.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.204 -0.453 . . . . 53.44 110.97 179.935 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 227' ' ' SER . . . . . 0.411 ' O ' HD12 ' A' ' 231' ' ' ILE . 2.3 t -86.4 160.43 19.06 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.285 -0.416 . . . . 74.21 110.911 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -63.29 -64.94 0.76 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.134 -0.485 . . . . 74.54 110.925 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -55.58 -26.55 44.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.204 -0.453 . . . . 72.22 110.822 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.36 -48.63 60.69 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.314 -0.403 . . . . 74.23 110.865 -179.934 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 231' ' ' ILE . . . . . 0.667 HG23 ' HB3' ' A' ' 119' ' ' GLU . 7.6 mt -69.06 -42.92 82.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.243 -0.435 . . . . 73.41 111.168 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.57 -32.13 73.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.167 -0.47 . . . . 65.42 110.919 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -63.1 -49.0 75.31 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.749 -0.738 . . . . 63.43 112.472 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 234' ' ' ILE . . . . . 0.657 HD12 ' SD ' ' A' ' 202' ' ' MET . 7.3 tt -72.97 -32.45 39.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.759 0.314 . . . . 71.54 111.11 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -70.12 -24.52 63.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.21 -0.45 . . . . 70.33 110.968 179.914 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 236' ' ' LYS . . . . . 0.431 ' HE2' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.32 -27.58 60.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.169 -0.469 . . . . 51.21 110.879 -179.991 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 237' ' ' LEU . . . . . 0.742 HD22 ' CD ' ' A' ' 83' ' ' LYS . 3.8 tt -97.78 -26.74 14.61 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.241 -0.436 . . . . 75.41 110.907 179.938 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 238' ' ' TYR . . . . . 0.449 ' OH ' HD11 ' A' ' 122' ' ' LEU . 4.4 m-85 -91.96 -35.2 14.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.194 -0.457 . . . . 51.24 110.985 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.293 0 C-N-CA 120.794 -0.717 . . . . 32.22 112.499 179.964 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 50.3 t-105 . . . . . 0 C--O 1.23 0.056 0 CA-C-O 120.796 0.331 . . . . 71.22 110.983 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -58.88 -35.62 73.29 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.202 -0.454 . . . . 72.51 110.884 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.09 -36.64 84.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.185 -0.461 . . . . 61.24 110.857 -179.863 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.1 -42.4 80.69 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.251 -0.432 . . . . 54.34 111.138 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.569 ' OE1' HD12 ' A' ' 35' ' ' LEU . 1.7 tt0 -73.07 -43.03 62.41 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.187 -0.46 . . . . 73.12 110.927 -179.926 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -61.63 -32.44 72.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.243 -0.435 . . . . 72.4 110.938 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 8.5 m-85 -70.38 -37.07 74.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.15 -0.477 . . . . 75.11 110.953 -179.853 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.617 HD13 ' O ' ' A' ' 19' ' ' LEU . 3.0 tm? -71.73 -24.54 61.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.108 -0.496 . . . . 72.51 110.869 179.975 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.441 ' HE2' ' HA ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -72.23 -42.36 65.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.238 -0.437 . . . . 74.41 110.918 179.801 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.441 ' HA ' ' HE2' ' A' ' 20' ' ' LYS . 3.2 ptm180 -67.93 -28.19 67.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.19 -0.459 . . . . 74.05 110.887 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.431 ' N ' ' HG3' ' A' ' 21' ' ' ARG . 2.0 m-85 -62.13 -25.09 67.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.199 -0.455 . . . . 74.31 110.86 -179.944 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 . . . . . 0 C--N 1.328 -0.354 0 CA-C-N 116.143 -0.48 . . . . 72.55 110.92 -179.843 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.569 HD12 ' OE1' ' A' ' 16' ' ' GLN . 0.8 OUTLIER . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.803 0.335 . . . . 72.52 110.921 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.473 ' N ' HD23 ' A' ' 35' ' ' LEU . 0.4 OUTLIER -63.63 -53.12 56.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.195 -0.457 . . . . 73.13 110.843 179.944 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -59.35 -49.32 78.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.156 -0.475 . . . . 63.32 111.071 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.556 ' HD3' HD12 ' A' ' 19' ' ' LEU . 33.7 tttt -59.91 -38.79 83.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.225 -0.443 . . . . 72.32 110.92 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.461 HD22 ' HG ' ' A' ' 35' ' ' LEU . 0.8 OUTLIER -67.53 -35.93 80.04 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.267 -0.424 . . . . 72.11 110.931 179.888 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 19.3 mttt -63.14 -45.17 93.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.123 -0.489 . . . . 62.43 110.951 179.849 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -69.48 -33.32 72.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.191 -0.458 . . . . 75.11 110.903 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.563 ' CE ' HD11 ' A' ' 61' ' ' ILE . 1.9 ttt -66.06 -47.66 73.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.137 -0.483 . . . . 63.43 110.922 179.971 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.693 ' HA ' HD12 ' A' ' 48' ' ' LEU . 17.4 mt-30 -58.64 -39.65 81.18 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.223 -0.444 . . . . 74.45 110.896 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.8 mmpt? -59.23 -20.57 55.19 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.248 -0.433 . . . . 71.43 110.823 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 68.8 t80 -70.42 -46.3 64.2 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.274 -0.421 . . . . 73.32 110.817 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.625 ' CE1' HD12 ' A' ' 61' ' ' ILE . 36.1 m-85 -81.82 -3.78 54.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.175 -0.466 . . . . 70.43 110.888 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.45 12.49 84.49 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.689 -0.767 . . . . 64.34 112.475 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.693 HD12 ' HA ' ' A' ' 43' ' ' GLN . 0.3 OUTLIER -59.73 140.58 89.45 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.568 0.699 . . . . 64.11 110.941 -179.936 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.8 -53.29 0.28 Allowed 'Trans proline' 0 C--O 1.231 0.159 0 C-N-CA 122.72 2.28 . . . . 74.5 112.318 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.545 HD11 ' HB3' ' A' ' 48' ' ' LEU . 0.8 OUTLIER -53.33 139.25 11.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 71.22 111.032 179.969 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -129.63 126.94 39.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.133 -0.485 . . . . 73.25 111.174 179.877 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 85.07 5.69 85.62 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.735 -0.745 . . . . 64.24 112.509 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -135.05 154.63 51.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.829 0.347 . . . . 75.23 110.864 -179.942 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.428 HD23 ' CD2' ' A' ' 39' ' ' LEU . 2.8 pp -159.16 130.23 6.11 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.203 -0.453 . . . . 73.4 110.955 179.966 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 173.96 -24.38 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.132 -0.486 . . . . 44.35 110.898 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -104.09 -81.27 0.52 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 75.25 110.912 -179.888 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.672 ' O ' HG23 ' A' ' 61' ' ' ILE . 0.1 OUTLIER -84.3 -45.55 12.71 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.161 -0.472 . . . . 61.22 110.954 179.974 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.525 HG22 HD13 ' A' ' 48' ' ' LEU . 41.3 t -57.14 -45.69 84.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.124 -0.489 . . . . 70.12 111.129 179.94 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.423 HD13 ' HB2' ' A' ' 62' ' ' MET . 0.2 OUTLIER -74.63 -30.45 25.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.163 -0.472 . . . . 74.43 111.105 179.989 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -59.62 -40.47 87.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.174 -0.466 . . . . 73.45 110.832 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.672 HG23 ' O ' ' A' ' 57' ' ' ARG . 0.5 OUTLIER -68.43 -29.43 44.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.156 -0.474 . . . . 74.52 111.115 -179.968 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 62' ' ' MET . . . . . 0.423 ' HB2' HD13 ' A' ' 59' ' ' ILE . 6.9 mtt -65.19 -32.68 74.48 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.161 -0.472 . . . . 74.01 110.932 179.775 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -100.66 -26.48 13.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.16 -0.473 . . . . 42.22 110.913 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.35 119.01 71.89 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.52 0.676 . . . . 65.34 110.932 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.71 143.36 50.83 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.706 2.271 . . . . 72.11 112.33 179.889 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 2.0 ppt_? -155.73 -53.73 0.09 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.192 -0.458 . . . . 71.51 110.882 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 6.4 t -139.42 123.88 18.23 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.163 -0.471 . . . . 55.3 110.928 -179.944 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.534 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -79.33 -36.91 25.81 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.747 -0.739 . . . . 64.23 112.462 -179.888 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.673 HG21 ' O ' ' A' ' 159' ' ' ALA . 1.1 t -64.71 146.45 98.45 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-O 121.592 0.71 . . . . 74.23 111.209 -179.988 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' PRO . . . . . 0.515 ' HD2' HG22 ' A' ' 69' ' ' VAL . 52.9 Cg_endo -69.81 159.85 51.84 Favored 'Trans proline' 0 C--O 1.231 0.166 0 C-N-CA 122.675 2.25 . . . . 63.44 112.302 -180.0 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -85.0 -0.29 53.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.219 -0.446 . . . . 74.45 110.876 179.925 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.9 m . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.199 -0.455 . . . . 53.43 111.095 -179.954 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo . . . . . 0 C--O 1.232 0.195 0 CA-C-O 120.865 0.277 . . . . 71.11 112.316 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.764 ' HD2' HD13 ' A' ' 237' ' ' LEU . 4.2 mtpt -88.98 150.72 22.68 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.229 -0.441 . . . . 64.45 110.906 179.928 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' TRP . . . . . 0.414 ' CH2' ' HB3' ' A' ' 162' ' ' PRO . 95.6 m95 -50.96 132.54 27.24 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.324 -0.398 . . . . 73.31 110.935 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -114.48 -10.66 12.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.307 -0.406 . . . . 65.3 111.147 -179.916 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -64.85 -176.77 0.29 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.241 -0.436 . . . . 70.34 110.909 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 9.7 mptt -99.39 -11.14 21.43 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.116 -0.493 . . . . 71.12 110.885 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -156.19 142.1 10.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.172 -0.467 . . . . 74.14 111.141 179.877 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 90.5 t -118.46 130.51 73.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.101 -0.499 . . . . 72.25 111.156 179.865 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -115.95 161.57 18.64 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.202 -0.453 . . . . 71.01 111.128 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 4.6 p90 -149.37 147.16 27.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 70.51 110.88 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -150.07 138.86 20.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.103 -0.498 . . . . 71.25 110.96 -179.946 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.441 HD11 ' HA ' ' A' ' 106' ' ' ASP . 10.0 mm -78.29 133.48 30.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.24 -0.436 . . . . 72.4 111.169 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.485 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 18.8 t -86.91 -40.47 14.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.194 -0.457 . . . . 60.2 111.201 179.825 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 2.9 t -143.67 169.38 17.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.128 -0.487 . . . . 64.24 110.859 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 8.8 p90 -111.62 148.88 32.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.165 -0.47 . . . . 72.25 110.926 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.51 ' OG1' HG21 ' A' ' 105' ' ' VAL . 0.2 OUTLIER -82.91 141.05 32.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.071 -0.513 . . . . 64.11 111.134 -179.986 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 2.8 ppt_? -71.7 -8.76 56.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.209 -0.45 . . . . 72.14 110.799 -179.925 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -96.6 -25.79 15.47 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.199 -0.455 . . . . 74.13 110.876 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.468 ' O ' ' O ' ' A' ' 97' ' ' THR . 1.1 mp -137.68 152.45 72.68 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.618 0.723 . . . . 72.52 110.927 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 101' ' ' PRO . . . . . 0.599 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.9 Cg_endo -69.73 150.95 69.1 Favored 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 122.701 2.268 . . . . 73.11 112.309 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 4.7 t-160 -52.06 -25.59 9.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.455 . . . . 74.11 110.837 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.599 HG22 ' HB2' ' A' ' 101' ' ' PRO . 11.7 tt -77.26 -37.47 25.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.263 -0.426 . . . . 74.02 111.143 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 104' ' ' THR . . . . . 0.795 ' O ' HD22 ' A' ' 108' ' ' LEU . 3.4 m -68.94 -39.19 79.71 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.174 -0.467 . . . . 52.11 111.13 179.941 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.792 ' O ' HG13 ' A' ' 109' ' ' VAL . 81.1 t -71.76 -45.74 64.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.212 -0.449 . . . . 71.51 111.145 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.624 ' O ' HG22 ' A' ' 109' ' ' VAL . 16.0 t0 -62.61 -39.53 94.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.208 -0.451 . . . . 63.44 110.917 179.927 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 107' ' ' ARG . . . . . 0.499 ' HG3' ' N ' ' A' ' 108' ' ' LEU . 0.0 OUTLIER -70.57 -33.8 71.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.168 -0.469 . . . . 75.02 110.926 179.996 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.795 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -65.61 -49.56 68.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.202 -0.453 . . . . 71.04 110.934 -179.971 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.792 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.6 m -55.83 -42.93 72.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.183 -0.462 . . . . 72.31 111.059 179.877 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.489 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 44.6 t -70.2 -34.17 72.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.13 -0.487 . . . . 72.14 110.903 -179.824 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.496 ' CG ' HD21 ' A' ' 189' ' ' LEU . 0.4 OUTLIER -62.16 -33.25 74.16 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.105 -0.498 . . . . 74.35 110.942 179.878 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.43 -40.28 9.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.272 -0.422 . . . . 74.32 111.16 179.755 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.852 HD12 HD12 ' A' ' 196' ' ' LEU . 0.4 OUTLIER -65.59 -33.2 75.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 72.0 110.949 179.97 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -69.59 -44.42 70.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.15 -0.477 . . . . 72.34 110.87 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 115' ' ' MET . . . . . 0.492 ' O ' HD11 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -57.84 -34.86 70.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.207 -0.452 . . . . 54.12 110.843 179.936 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 5.1 m95 -62.53 -47.44 83.91 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.287 -0.415 . . . . 75.23 110.91 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 117' ' ' GLY . . . . . 0.482 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -72.97 -32.77 60.41 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.745 -0.741 . . . . 73.32 112.507 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.0 mmpt? -62.98 -14.3 45.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.842 0.353 . . . . 72.42 110.971 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.734 ' HG2' HD13 ' A' ' 226' ' ' LEU . 0.9 OUTLIER -104.65 13.71 31.07 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.112 -0.495 . . . . 75.24 110.906 179.904 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 1.063 HD12 HD12 ' A' ' 122' ' ' LEU . 5.8 pt -146.91 156.29 47.61 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.707 0.765 . . . . 71.34 111.063 -179.992 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.83 2.14 3.84 Favored 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 122.701 2.267 . . . . 72.21 112.333 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 1.063 HD12 HD12 ' A' ' 120' ' ' ILE . 7.1 mt -60.96 -157.42 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.219 -0.446 . . . . 73.22 110.892 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 30.5 t-80 -163.63 138.47 6.15 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.158 -0.474 . . . . 74.12 110.822 179.818 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 124' ' ' PHE . . . . . 0.469 ' CD2' HD21 ' A' ' 113' ' ' LEU . 37.3 m-85 -120.88 148.83 43.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.195 -0.457 . . . . 75.54 110.902 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.4 141.22 51.48 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.204 -0.453 . . . . 75.14 110.877 -179.879 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.51 140.04 36.07 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.219 -0.446 . . . . 72.22 110.84 179.973 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 127' ' ' VAL . . . . . 0.933 HG11 ' HB2' ' A' ' 132' ' ' ALA . 15.0 m -102.56 131.48 50.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.188 -0.46 . . . . 50.13 111.149 179.871 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.462 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -143.93 -22.33 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 74.43 111.122 179.962 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 129' ' ' TRP . . . . . 0.462 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -138.6 109.19 6.58 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.151 -0.477 . . . . 71.25 110.91 179.992 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.67 -159.59 14.4 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.655 -0.783 . . . . 62.11 112.49 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.87 155.71 17.98 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.788 0.327 . . . . 63.25 111.115 -179.86 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 132' ' ' ALA . . . . . 0.933 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -112.08 165.19 12.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.209 -0.45 . . . . 51.34 111.128 179.824 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -65.89 -62.61 1.4 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.23 -0.441 . . . . 75.41 110.888 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 53.6 mt -86.59 132.25 32.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.21 -0.45 . . . . 70.51 111.142 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 135' ' ' MET . . . . . 0.485 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 18.4 mmm -110.64 123.1 49.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.214 -0.448 . . . . 72.43 110.892 179.846 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.44 ' O ' HG23 ' A' ' 93' ' ' ILE . 0.5 OUTLIER -106.54 92.87 2.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.256 -0.429 . . . . 70.04 111.133 179.983 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 137' ' ' GLY . . . . . 0.453 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -135.56 162.58 24.91 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.783 -0.722 . . . . 63.34 112.491 179.911 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -105.25 142.53 34.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.856 0.36 . . . . 74.01 110.918 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.486 ' HB1' ' HB3' ' A' ' 143' ' ' HIS . . . 179.74 168.02 1.18 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.199 -0.455 . . . . 71.21 111.107 179.891 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 38.3 mtm180 -103.29 173.43 6.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.226 -0.443 . . . . 62.21 110.899 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -52.8 -19.06 6.31 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.755 -0.736 . . . . 74.24 112.495 -179.931 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -87.89 13.36 10.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.857 0.36 . . . . 75.03 111.127 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 143' ' ' HIS . . . . . 0.486 ' HB3' ' HB1' ' A' ' 139' ' ' ALA . 11.0 p80 -77.05 -22.02 53.59 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.17 -0.468 . . . . 71.11 110.823 -179.924 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 138.18 52.67 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.798 -0.715 . . . . 45.51 112.509 -179.932 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 34.4 p-10 -173.36 156.59 3.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.885 0.374 . . . . 72.14 110.815 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 9.7 m -71.69 173.48 8.07 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.124 -0.489 . . . . 51.25 110.859 -179.781 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 147' ' ' TYR . . . . . 0.434 ' HA ' ' HD2' ' A' ' 148' ' ' PRO . 0.1 OUTLIER 63.1 106.82 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.571 0.7 . . . . 73.4 110.902 -179.887 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 148' ' ' PRO . . . . . 0.434 ' HD2' ' HA ' ' A' ' 147' ' ' TYR . 54.4 Cg_endo -69.71 143.54 51.41 Favored 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.717 2.278 . . . . 74.53 112.353 179.887 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 149' ' ' PHE . . . . . 0.454 ' CE1' ' HB2' ' A' ' 173' ' ' ASP . 0.1 OUTLIER -64.2 -14.7 57.03 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.247 -0.433 . . . . 63.52 110.931 179.943 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 75.6 -4.11 2.44 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.127 -0.488 . . . . 63.11 110.85 179.934 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 66.92 -137.96 34.48 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.711 -0.757 . . . . 71.41 112.515 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.72 141.33 45.08 Favored 'Trans proline' 0 C--O 1.231 0.144 0 C-N-CA 122.699 2.266 . . . . 75.11 112.37 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 103.4 -144.9 16.07 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.778 -0.725 . . . . 70.32 112.456 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -39.01 150.19 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.967 0.413 . . . . 73.25 110.88 -179.834 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 155' ' ' THR . . . . . 0.409 ' CG2' ' HA2' ' A' ' 68' ' ' GLY . 0.2 OUTLIER 75.24 103.71 0.07 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.163 -0.471 . . . . 44.41 111.129 -179.956 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 156' ' ' LEU . . . . . 1.009 HD21 HG21 ' A' ' 186' ' ' ILE . 0.5 OUTLIER -87.08 -54.98 4.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.224 -0.444 . . . . 75.02 110.96 179.911 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 157' ' ' ALA . . . . . 0.557 ' HB1' ' O ' ' A' ' 171' ' ' HIS . . . -162.11 148.47 13.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.471 . . . . 71.42 111.045 179.76 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 32.0 p-80 -112.28 118.74 36.11 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.143 -0.48 . . . . 72.02 110.821 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 159' ' ' ALA . . . . . 0.673 ' O ' HG21 ' A' ' 69' ' ' VAL . . . -111.16 150.18 29.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 74.42 111.098 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -120.65 172.83 7.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.183 -0.462 . . . . 75.31 110.904 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 161' ' ' ALA . . . . . 0.695 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -104.12 164.26 15.67 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.591 0.71 . . . . 61.04 111.133 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 162' ' ' PRO . . . . . 0.695 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.3 Cg_endo -69.8 88.49 0.54 Allowed 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.68 2.254 . . . . 74.44 112.38 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -124.27 120.44 4.07 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.798 -0.715 . . . . 61.41 112.53 179.996 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 2.3 m 73.41 -68.33 0.23 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.823 0.344 . . . . 73.1 111.175 -179.819 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . 176.46 -61.67 0.1 Allowed Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.714 -0.755 . . . . 74.03 112.442 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 166' ' ' LEU . . . . . 0.541 HD23 ' O ' ' A' ' 166' ' ' LEU . 9.7 tt -53.95 -30.99 49.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.854 0.359 . . . . 65.12 110.897 -179.89 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -72.43 -173.87 22.97 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.765 -0.731 . . . . 43.43 112.465 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 73.01 22.93 78.75 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.69 -0.767 . . . . 74.31 112.498 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -100.44 161.6 13.49 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.859 0.362 . . . . 63.41 110.882 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.56 130.76 55.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.204 -0.453 . . . . 74.21 111.024 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 171' ' ' HIS . . . . . 0.557 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 48.3 m170 -127.0 132.74 50.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.181 -0.463 . . . . 72.53 110.862 -180.0 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 38.0 m-85 -116.13 138.86 50.88 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.238 -0.437 . . . . 71.44 110.883 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 173' ' ' ASP . . . . . 0.454 ' HB2' ' CE1' ' A' ' 149' ' ' PHE . 11.1 t0 -64.92 95.19 0.15 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 74.11 110.858 179.983 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 2.9 pp20? -55.64 -18.7 8.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.23 -0.441 . . . . 72.25 110.904 -179.932 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.82 -22.73 42.68 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.177 -0.465 . . . . 73.32 110.884 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 176' ' ' GLU . . . . . 0.438 ' HG3' HD13 ' A' ' 156' ' ' LEU . 0.0 OUTLIER -72.73 -170.99 0.76 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 63.2 110.89 -179.926 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 177' ' ' ARG . . . . . 0.409 ' HG3' ' HA3' ' A' ' 185' ' ' GLY . 0.5 OUTLIER -116.57 114.37 24.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.166 -0.47 . . . . 63.14 110.909 -179.88 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 48.6 m95 -116.77 142.77 46.49 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.173 -0.467 . . . . 72.31 111.014 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 179' ' ' THR . . . . . 0.511 HG21 ' HB3' ' A' ' 182' ' ' SER . 13.1 t -177.66 163.57 1.91 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.279 -0.419 . . . . 74.13 111.183 -179.942 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -125.0 -68.86 0.82 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.22 -0.445 . . . . 45.33 110.913 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -63.6 -13.13 49.79 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.736 -0.745 . . . . 62.41 112.555 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 182' ' ' SER . . . . . 0.511 ' HB3' HG21 ' A' ' 179' ' ' THR . 0.3 OUTLIER -93.48 -24.39 18.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.917 0.389 . . . . 64.5 110.877 -179.8 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 183' ' ' SER . . . . . 0.402 ' C ' ' O ' ' A' ' 182' ' ' SER . 7.4 p 37.97 43.78 0.56 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.091 -0.504 . . . . 64.12 110.854 -179.809 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 1.2 tt -107.51 -33.39 7.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.104 -0.498 . . . . 74.2 110.91 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 185' ' ' GLY . . . . . 0.409 ' HA3' ' HG3' ' A' ' 177' ' ' ARG . . . -113.42 -145.58 9.3 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.736 -0.745 . . . . 73.01 112.485 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 186' ' ' ILE . . . . . 1.009 HG21 HD21 ' A' ' 156' ' ' LEU . 8.2 mm -79.03 99.54 3.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.893 0.377 . . . . 73.22 111.125 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -44.27 123.85 3.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.466 . . . . 71.31 110.873 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 188' ' ' PHE . . . . . 0.702 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.4 t80 -59.83 -38.45 82.06 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.098 -0.501 . . . . 75.45 110.872 -179.92 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 189' ' ' LEU . . . . . 0.496 HD21 ' CG ' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -67.34 -47.61 69.97 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.129 -0.487 . . . . 52.02 110.895 179.984 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 65.6 t80 -67.54 -39.86 84.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.248 -0.433 . . . . 74.22 110.931 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 191' ' ' ALA . . . . . 0.566 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -72.5 -35.21 68.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.091 -0.504 . . . . 50.03 111.121 179.903 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 192' ' ' ALA . . . . . 0.686 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -57.37 -44.69 84.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 52.11 111.079 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 193' ' ' THR . . . . . 0.403 HG21 HG21 ' A' ' 211' ' ' VAL . 13.6 m -58.28 -43.41 88.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.225 -0.443 . . . . 72.43 111.137 -179.911 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 34.1 t60 -72.82 -42.97 63.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.2 -0.455 . . . . 71.44 110.863 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -69.87 -47.72 61.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.221 -0.445 . . . . 71.01 111.106 179.9 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 196' ' ' LEU . . . . . 0.852 HD12 HD12 ' A' ' 113' ' ' LEU . 4.5 mm? -64.62 -33.58 76.28 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.217 -0.447 . . . . 74.51 110.865 -179.942 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -63.58 -26.55 69.85 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.701 -0.761 . . . . 52.23 112.475 179.934 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 198' ' ' HIS . . . . . . . . . . . . . 4.3 m-70 -67.07 -42.66 84.31 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.825 0.345 . . . . 75.21 110.813 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 199' ' ' SER . . . . . 0.416 ' O ' ' HD3' ' A' ' 162' ' ' PRO . 0.1 OUTLIER -61.85 -20.53 63.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.225 -0.443 . . . . 71.13 110.865 -179.755 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 200' ' ' LEU . . . . . 0.423 ' N ' HD23 ' A' ' 200' ' ' LEU . 1.7 mt -86.37 3.2 44.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.091 -0.504 . . . . 64.13 110.872 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 84.1 -9.35 63.79 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.714 -0.755 . . . . 50.41 112.466 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 202' ' ' MET . . . . . . . . . . . . . 42.1 tpp -54.72 153.93 5.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.847 0.356 . . . . 63.21 110.914 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -117.68 177.97 16.79 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.699 -0.762 . . . . 64.44 112.467 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 204' ' ' HIS . . . . . 0.414 ' HA ' ' HB3' ' A' ' 212' ' ' MET . 45.6 m-70 -77.92 149.97 34.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.799 0.333 . . . . 74.32 110.833 -179.955 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 66.2 m -121.86 149.91 42.69 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.18 -0.463 . . . . 53.34 110.835 -179.769 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 79.1 p -87.79 -4.37 58.88 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.126 -0.488 . . . . 72.22 110.849 -179.796 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 207' ' ' ASP . . . . . 0.42 ' HB2' ' HB2' ' A' ' 210' ' ' ALA . 8.4 m-20 -71.62 130.45 87.23 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.614 0.721 . . . . 65.11 110.858 179.974 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.72 -8.28 23.19 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.688 2.258 . . . . 74.53 112.351 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -116.26 11.09 15.0 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.145 -0.48 . . . . 63.52 110.915 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 210' ' ' ALA . . . . . 0.484 ' HB1' ' CE ' ' A' ' 212' ' ' MET . . . -87.18 146.02 26.18 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.132 -0.486 . . . . 62.23 111.088 179.838 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 211' ' ' VAL . . . . . 0.431 HG12 ' HG3' ' A' ' 212' ' ' MET . 0.4 OUTLIER -70.47 -25.07 26.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.196 -0.456 . . . . 62.04 111.104 179.902 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 212' ' ' MET . . . . . 0.492 ' HE2' ' HB2' ' A' ' 230' ' ' ASP . 0.4 OUTLIER -86.35 3.19 44.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.199 -0.455 . . . . 75.22 110.901 179.937 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 213' ' ' TYR . . . . . 0.44 ' HB2' ' O ' ' A' ' 210' ' ' ALA . 2.0 t80 -54.85 110.23 2.05 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-O 121.636 0.731 . . . . 73.43 110.887 -179.88 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.77 -18.55 36.89 Favored 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.705 2.27 . . . . 63.01 112.41 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 215' ' ' THR . . . . . 0.402 ' HB ' ' CE2' ' A' ' 213' ' ' TYR . 0.2 OUTLIER -84.27 53.6 2.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.184 -0.462 . . . . 74.24 111.116 -179.959 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 5.6 t80 . . . . . 0 C--N 1.328 -0.351 0 CA-C-N 116.26 -0.427 . . . . 74.14 110.914 -179.93 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.913 0.387 . . . . 65.01 110.841 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.37 147.89 35.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.11 -0.495 . . . . 64.24 110.917 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 226' ' ' LEU . . . . . 0.734 HD13 ' HG2' ' A' ' 119' ' ' GLU . 10.1 mt -75.45 148.92 38.68 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.203 -0.453 . . . . 53.44 110.924 179.973 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 227' ' ' SER . . . . . 0.427 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 2.1 t -87.2 155.3 20.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.241 -0.436 . . . . 74.21 110.84 -179.926 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -64.11 -66.25 0.57 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.099 -0.5 . . . . 74.54 110.957 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -55.69 -25.62 40.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.181 -0.463 . . . . 72.22 110.904 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 230' ' ' ASP . . . . . 0.492 ' HB2' ' HE2' ' A' ' 212' ' ' MET . 1.3 t70 -68.84 -48.45 63.45 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.169 -0.469 . . . . 74.23 110.855 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 231' ' ' ILE . . . . . 0.634 HG23 ' HB3' ' A' ' 119' ' ' GLU . 12.0 mt -68.21 -42.26 84.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.231 -0.44 . . . . 73.41 111.067 180.0 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 15.2 pttm -65.9 -32.14 73.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.199 -0.455 . . . . 65.42 110.929 179.879 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -62.62 -46.63 93.34 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.756 -0.735 . . . . 63.43 112.472 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 12.2 tt -72.93 -30.54 32.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.779 0.323 . . . . 71.54 111.101 -179.95 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -70.96 -24.71 62.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.174 -0.466 . . . . 70.33 110.879 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 236' ' ' LYS . . . . . 0.428 ' HE2' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.1 -26.82 60.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.218 -0.446 . . . . 51.21 110.903 179.969 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 237' ' ' LEU . . . . . 0.764 HD13 ' HD2' ' A' ' 83' ' ' LYS . 10.3 tt -97.25 -24.54 15.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.224 -0.443 . . . . 75.41 110.937 179.878 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 238' ' ' TYR . . . . . 0.625 ' CZ ' HD11 ' A' ' 122' ' ' LEU . 6.3 m-85 -92.36 -35.07 13.92 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.228 -0.442 . . . . 51.24 110.913 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.28 0 C-N-CA 120.791 -0.718 . . . . 32.22 112.524 179.988 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 11.6 t-105 . . . . . 0 C--O 1.23 0.049 0 CA-C-O 120.764 0.316 . . . . 71.22 110.954 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -73.28 -35.37 66.15 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.217 -0.447 . . . . 72.51 110.861 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -62.96 -36.92 85.06 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.229 -0.441 . . . . 61.24 110.92 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.632 ' CB ' HD21 ' A' ' 54' ' ' LEU . . . -59.16 -41.2 87.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 54.34 111.078 179.889 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 43.1 tp60 -72.92 -42.99 62.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.245 -0.434 . . . . 73.12 110.911 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -65.86 -31.82 72.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.219 -0.446 . . . . 72.4 110.847 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -70.33 -35.86 73.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.172 -0.467 . . . . 75.11 110.85 -179.725 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.682 HD13 ' HG2' ' A' ' 38' ' ' LYS . 1.9 mt -71.06 -21.03 62.3 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.157 -0.474 . . . . 72.51 110.952 179.925 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.0 ptmt -75.35 -29.88 60.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.128 -0.487 . . . . 74.41 110.856 179.867 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.7 ptp180 -86.2 -27.22 24.65 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.259 -0.428 . . . . 74.05 110.839 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -59.62 -21.24 60.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.207 -0.451 . . . . 74.31 110.885 -179.888 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.439 ' CE2' HD22 ' A' ' 19' ' ' LEU . 5.8 m-85 . . . . . 0 C--N 1.328 -0.363 0 CA-C-N 116.164 -0.471 . . . . 72.55 110.939 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.437 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 8.6 tt . . . . . 0 C--O 1.23 0.056 0 CA-C-O 120.74 0.305 . . . . 72.52 110.885 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.44 -51.25 70.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.204 -0.453 . . . . 73.13 110.894 179.918 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -66.04 -36.6 83.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.171 -0.468 . . . . 63.32 111.126 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.682 ' HG2' HD13 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -65.59 -49.08 70.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.447 . . . . 72.32 110.912 179.934 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.439 ' CD2' HD12 ' A' ' 19' ' ' LEU . 4.6 mt -63.19 -35.38 80.11 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.156 -0.475 . . . . 72.11 110.914 179.924 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.8 tttt -68.48 -45.73 71.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.249 -0.432 . . . . 62.43 110.876 179.83 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.547 ' HG3' ' N ' ' A' ' 42' ' ' MET . 0.0 OUTLIER -59.93 -31.87 70.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.193 -0.458 . . . . 75.11 110.946 179.949 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.726 ' CE ' HD11 ' A' ' 61' ' ' ILE . 38.2 ttp -68.5 -34.09 75.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.142 -0.481 . . . . 63.43 110.901 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.458 ' OE1' HD11 ' A' ' 48' ' ' LEU . 1.2 mm-40 -60.65 -39.44 88.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.209 -0.45 . . . . 74.45 110.92 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.1 mmpt? -68.37 -28.36 67.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.47 . . . . 71.43 110.874 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 28.1 t80 -70.28 -45.01 67.2 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.18 -0.464 . . . . 73.32 110.86 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.588 ' CZ ' HD12 ' A' ' 61' ' ' ILE . 17.2 m-85 -81.98 -35.12 29.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.174 -0.466 . . . . 70.43 110.913 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 102.73 -7.13 52.9 Favored Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.75 -0.738 . . . . 64.34 112.466 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.474 HD23 ' CB ' ' A' ' 46' ' ' PHE . 0.8 OUTLIER -59.82 138.78 90.33 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.565 0.697 . . . . 64.11 110.968 -179.975 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.519 ' O ' HG23 ' A' ' 51' ' ' THR . 53.9 Cg_endo -69.73 -53.01 0.29 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.651 2.234 . . . . 74.5 112.374 179.886 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.664 HD12 HG23 ' A' ' 58' ' ' VAL . 0.9 OUTLIER -51.32 108.22 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.215 -0.448 . . . . 71.22 111.126 179.881 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.519 HG23 ' O ' ' A' ' 49' ' ' PRO . 41.4 p -109.0 164.37 12.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.178 -0.464 . . . . 73.25 111.118 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 59.56 17.65 41.62 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.723 -0.751 . . . . 64.24 112.475 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -114.57 161.05 18.56 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.857 0.361 . . . . 75.23 110.837 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.632 HD21 ' CB ' ' A' ' 15' ' ' ALA . 26.8 tp -168.56 84.99 0.17 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.206 -0.452 . . . . 73.4 110.903 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.418 ' HA ' HG13 ' A' ' 59' ' ' ILE . 3.4 p30 175.55 -29.24 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.148 -0.478 . . . . 44.35 110.91 179.914 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 28.5 t -90.84 -100.52 0.1 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.156 -0.474 . . . . 75.25 110.902 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.587 ' O ' HG23 ' A' ' 61' ' ' ILE . 10.7 tpt180 -85.05 -28.89 25.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.155 -0.475 . . . . 61.22 110.884 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.664 HG23 HD12 ' A' ' 50' ' ' ILE . 66.6 t -64.98 -41.56 92.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.188 -0.46 . . . . 70.12 111.103 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.425 HD11 ' HB2' ' A' ' 15' ' ' ALA . 1.0 OUTLIER -74.59 -31.45 27.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.206 -0.452 . . . . 74.43 111.164 179.895 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.03 -33.09 70.34 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.121 -0.49 . . . . 73.45 110.91 179.925 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.726 HD11 ' CE ' ' A' ' 42' ' ' MET . 0.4 OUTLIER -76.45 -29.56 18.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.125 -0.489 . . . . 74.52 111.093 -179.975 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 62' ' ' MET . . . . . 0.417 ' HE3' ' HB1' ' A' ' 15' ' ' ALA . 5.2 mmt -64.41 -37.35 87.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.144 -0.48 . . . . 74.01 110.88 179.891 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -86.58 -23.29 25.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.26 -0.427 . . . . 42.22 110.918 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -85.08 124.97 71.58 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.588 0.709 . . . . 65.34 110.842 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 160.49 49.51 Favored 'Trans proline' 0 C--O 1.233 0.254 0 C-N-CA 122.683 2.255 . . . . 72.11 112.406 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -155.53 -77.46 0.1 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.31 -0.405 . . . . 71.51 110.914 -179.957 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -145.18 155.18 43.13 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.119 -0.491 . . . . 55.3 110.843 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.561 ' HA2' HG23 ' A' ' 155' ' ' THR . . . -97.53 11.81 64.86 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.727 -0.749 . . . . 64.23 112.534 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.652 HG21 ' CD2' ' A' ' 198' ' ' HIS . 0.9 OUTLIER -92.37 136.47 25.51 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.703 0.763 . . . . 74.23 111.139 -179.958 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 70' ' ' PRO . . . . . 0.507 ' HD2' HG12 ' A' ' 69' ' ' VAL . 54.1 Cg_endo -69.75 155.1 66.87 Favored 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.691 2.26 . . . . 63.44 112.338 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -92.66 15.49 14.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.224 -0.444 . . . . 74.45 110.88 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.183 -0.462 . . . . 53.43 111.108 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo . . . . . 0 N--CA 1.465 -0.151 0 CA-C-O 120.898 0.291 . . . . 71.11 112.378 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.748 ' HD2' HD22 ' A' ' 237' ' ' LEU . 2.6 mttm -84.08 161.74 20.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.157 -0.474 . . . . 64.45 110.895 179.885 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 84' ' ' TRP . . . . . 0.751 ' CE3' HG21 ' A' ' 89' ' ' VAL . 40.6 m0 -49.63 123.48 7.87 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.158 -0.474 . . . . 73.31 110.983 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 9.9 t -115.19 -19.43 10.82 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.241 -0.436 . . . . 65.3 111.128 -179.888 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -53.46 160.98 1.08 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.216 -0.447 . . . . 70.34 110.832 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 2.8 ptmt -74.03 -30.61 62.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.064 -0.516 . . . . 71.12 110.892 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -152.72 144.54 15.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.235 -0.439 . . . . 74.14 111.105 179.938 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.751 HG21 ' CE3' ' A' ' 84' ' ' TRP . 12.2 t -130.77 140.95 47.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.22 -0.445 . . . . 72.25 111.101 179.852 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.764 HG22 ' HB3' ' A' ' 125' ' ' ARG . 11.0 p -117.18 167.94 10.74 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.088 -0.505 . . . . 71.01 111.128 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.435 ' HB3' ' HB ' ' A' ' 134' ' ' ILE . 4.9 p90 -150.35 146.55 26.8 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.198 -0.456 . . . . 70.51 110.961 -179.856 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 4.5 ttt-85 -146.29 136.24 23.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.165 -0.471 . . . . 71.25 110.854 -179.897 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.447 HD11 ' HA ' ' A' ' 106' ' ' ASP . 3.4 mp -74.76 135.54 27.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.169 -0.469 . . . . 72.4 111.195 179.903 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.405 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 19.3 t -89.15 -40.7 13.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.2 -0.454 . . . . 60.2 111.112 179.914 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 5.6 t -144.56 163.4 34.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.208 -0.451 . . . . 64.24 110.857 -179.852 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 11.2 p90 -110.58 152.47 26.39 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.138 -0.483 . . . . 72.25 110.921 -179.886 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.474 ' OG1' HG21 ' A' ' 105' ' ' VAL . 0.2 OUTLIER -82.68 140.99 32.8 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.117 -0.492 . . . . 64.11 111.173 -179.989 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.92 -7.8 52.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.197 -0.456 . . . . 72.14 110.923 179.987 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -96.42 -26.1 15.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.251 -0.431 . . . . 74.13 110.889 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.508 HD11 ' HA ' ' A' ' 179' ' ' THR . 0.9 OUTLIER -133.54 153.6 80.38 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.591 0.71 . . . . 72.52 111.006 -179.956 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 101' ' ' PRO . . . . . 0.569 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.9 Cg_endo -69.71 150.89 69.13 Favored 'Trans proline' 0 C--O 1.231 0.159 0 C-N-CA 122.703 2.269 . . . . 73.11 112.365 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 15.9 t-160 -52.74 -27.38 17.46 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.221 -0.445 . . . . 74.11 110.866 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.569 HG22 ' HB2' ' A' ' 101' ' ' PRO . 0.0 OUTLIER -75.72 -39.43 39.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.18 -0.463 . . . . 74.02 111.109 -179.956 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 104' ' ' THR . . . . . 0.681 ' O ' HD22 ' A' ' 108' ' ' LEU . 3.1 m -69.33 -39.13 78.37 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.114 -0.493 . . . . 52.11 111.154 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.689 ' O ' HG13 ' A' ' 109' ' ' VAL . 92.0 t -72.61 -44.83 60.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.224 -0.444 . . . . 71.51 111.119 179.904 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.635 ' O ' HG22 ' A' ' 109' ' ' VAL . 3.9 t0 -66.25 -41.91 89.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.215 -0.448 . . . . 63.44 110.841 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 6.6 ptm180 -69.9 -33.8 72.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 75.02 110.829 -179.839 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.681 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -60.73 -48.95 79.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.196 -0.456 . . . . 71.04 110.882 -179.96 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.689 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.3 m -55.61 -41.96 66.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.181 -0.463 . . . . 72.31 111.112 179.893 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.469 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 42.7 t -69.97 -34.1 72.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.142 -0.481 . . . . 72.14 110.874 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.453 ' CG ' HD21 ' A' ' 189' ' ' LEU . 0.4 OUTLIER -62.46 -33.33 74.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.111 -0.495 . . . . 74.35 110.882 179.964 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -94.02 -40.97 9.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.288 -0.415 . . . . 74.32 111.12 179.792 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.75 ' CD1' HD12 ' A' ' 196' ' ' LEU . 0.5 OUTLIER -65.47 -32.91 74.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.179 -0.464 . . . . 72.0 110.969 179.937 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -67.9 -38.06 82.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.226 -0.443 . . . . 72.34 110.946 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 115' ' ' MET . . . . . 0.657 ' O ' HD11 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -62.41 -34.62 77.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.083 -0.508 . . . . 54.12 110.881 179.871 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 116' ' ' TRP . . . . . 0.41 ' CZ3' ' SD ' ' A' ' 202' ' ' MET . 8.4 m95 -65.98 -52.29 50.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.198 -0.455 . . . . 75.23 110.929 -179.968 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -63.94 -37.22 94.31 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.728 -0.749 . . . . 73.32 112.453 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.41 -16.31 45.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.758 0.313 . . . . 72.42 110.888 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.65 ' HG3' HG21 ' A' ' 231' ' ' ILE . 0.2 OUTLIER -101.2 12.13 38.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.278 -0.419 . . . . 75.24 110.938 179.938 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 0.879 HD12 HD12 ' A' ' 122' ' ' LEU . 5.1 pt -149.7 149.36 28.07 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.59 0.709 . . . . 71.34 111.113 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.72 25.71 0.17 Allowed 'Trans proline' 0 C--O 1.231 0.166 0 C-N-CA 122.668 2.245 . . . . 72.21 112.354 179.92 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.879 HD12 HD12 ' A' ' 120' ' ' ILE . 9.9 mt -80.43 -157.53 0.15 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.193 -0.458 . . . . 73.22 110.908 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 123' ' ' HIS . . . . . 0.416 ' H ' ' HB3' ' A' ' 122' ' ' LEU . 20.8 t-80 -163.78 133.59 4.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 74.12 110.855 179.868 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 23.4 m-30 -119.59 142.58 48.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.242 -0.436 . . . . 75.54 110.899 -179.902 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.764 ' HB3' HG22 ' A' ' 90' ' ' THR . 0.1 OUTLIER -118.85 141.92 48.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.157 -0.474 . . . . 75.14 110.916 -179.991 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 126' ' ' LYS . . . . . 0.506 ' HE3' HG13 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -80.42 149.48 30.13 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.133 -0.485 . . . . 72.22 110.896 179.996 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 127' ' ' VAL . . . . . 1.024 HG11 ' HB2' ' A' ' 132' ' ' ALA . 27.4 m -103.21 126.5 57.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.267 -0.424 . . . . 50.13 111.086 179.933 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.587 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -143.55 -11.79 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.237 -0.438 . . . . 74.43 111.18 179.872 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 129' ' ' TRP . . . . . 0.587 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -153.78 109.22 3.2 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.178 -0.464 . . . . 71.25 110.931 179.967 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.59 -161.2 13.69 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.745 -0.74 . . . . 62.11 112.445 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -101.82 155.97 17.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.767 0.317 . . . . 63.25 111.117 -179.818 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 132' ' ' ALA . . . . . 1.024 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -111.93 165.3 12.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 51.34 111.132 179.84 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -75.9 -62.02 1.73 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.202 -0.454 . . . . 75.41 110.869 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 134' ' ' ILE . . . . . 0.635 HD12 ' N ' ' A' ' 134' ' ' ILE . 1.3 mp -82.57 107.5 14.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.254 -0.43 . . . . 70.51 111.117 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 135' ' ' MET . . . . . 0.405 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 11.1 mmm -92.94 131.78 37.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.221 -0.445 . . . . 72.43 110.876 179.797 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.589 ' CD1' HG22 ' A' ' 134' ' ' ILE . 0.3 OUTLIER -113.34 95.33 3.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.251 -0.432 . . . . 70.04 111.141 179.956 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -136.1 165.51 24.88 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.796 -0.716 . . . . 63.34 112.499 179.919 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 138' ' ' PHE . . . . . 0.543 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 43.5 m-85 -106.42 149.68 26.79 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.859 0.361 . . . . 74.01 110.861 -179.816 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.543 ' HB2' ' O ' ' A' ' 138' ' ' PHE . . . 170.49 166.42 0.07 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.138 -0.483 . . . . 71.21 111.113 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -104.6 173.53 6.26 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.213 -0.449 . . . . 62.21 110.87 -179.916 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -55.13 -17.45 10.54 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.797 -0.716 . . . . 74.24 112.454 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -87.33 12.97 10.68 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.795 0.331 . . . . 75.03 111.086 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 6.1 p80 -81.44 -4.38 55.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.235 -0.438 . . . . 71.11 110.788 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 124.68 7.31 6.23 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.778 -0.725 . . . . 45.51 112.521 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 29.1 m-20 -111.19 163.64 13.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.856 0.36 . . . . 72.14 110.854 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -87.44 176.89 7.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.173 -0.467 . . . . 51.25 110.854 -179.74 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 66.46 127.98 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.687 0.755 . . . . 73.4 110.933 -179.921 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.87 145.42 56.45 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.677 2.251 . . . . 74.53 112.332 179.967 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 149' ' ' PHE . . . . . 0.403 ' CE1' ' HB2' ' A' ' 173' ' ' ASP . 0.1 OUTLIER -90.87 -31.61 16.37 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.186 -0.461 . . . . 63.52 110.894 -179.985 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 74.39 -1.67 3.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.145 -0.48 . . . . 63.11 110.855 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 50.04 -108.52 0.5 Allowed Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.721 -0.752 . . . . 71.41 112.48 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -69.71 139.41 40.33 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.707 2.271 . . . . 75.11 112.401 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 103.29 -153.76 18.06 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.712 -0.756 . . . . 70.32 112.484 179.987 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 154' ' ' ASN . . . . . 0.412 ' O ' ' CB ' ' A' ' 155' ' ' THR . 4.4 p30 -42.77 155.06 0.06 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.904 0.383 . . . . 73.25 110.872 -179.883 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 155' ' ' THR . . . . . 0.561 HG23 ' HA2' ' A' ' 68' ' ' GLY . 0.2 OUTLIER 78.44 114.01 0.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.152 -0.476 . . . . 44.41 111.182 -179.95 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 156' ' ' LEU . . . . . 1.05 HD21 HG21 ' A' ' 186' ' ' ILE . 1.1 tp -101.49 -51.79 3.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.22 -0.446 . . . . 75.02 110.94 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 157' ' ' ALA . . . . . 0.533 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -159.65 148.46 17.74 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.11 -0.495 . . . . 71.42 111.113 179.812 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 37.0 p-80 -110.32 123.2 49.39 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.215 -0.448 . . . . 72.02 110.868 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 159' ' ' ALA . . . . . 0.55 ' H ' HG22 ' A' ' 69' ' ' VAL . . . -110.36 160.17 16.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.263 -0.426 . . . . 74.42 111.115 179.944 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 16.6 m-30 -118.91 163.32 17.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.205 -0.452 . . . . 75.31 110.852 -179.894 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 161' ' ' ALA . . . . . 0.725 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -88.09 165.02 31.22 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.543 0.687 . . . . 61.04 111.127 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 162' ' ' PRO . . . . . 0.725 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.6 Cg_endo -69.76 71.61 1.51 Allowed 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.629 2.219 . . . . 74.44 112.377 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -127.91 108.82 0.97 Allowed Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.77 -0.729 . . . . 61.41 112.491 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 1.4 p 59.23 173.74 0.07 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.79 0.329 . . . . 73.1 111.104 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -55.59 -33.74 59.56 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.667 -0.778 . . . . 74.03 112.514 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -71.28 -18.03 62.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.83 0.348 . . . . 65.12 110.89 -179.929 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -88.93 167.29 34.56 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.762 -0.732 . . . . 43.43 112.559 179.854 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 168' ' ' GLY . . . . . 0.445 ' O ' HG13 ' A' ' 134' ' ' ILE . . . 72.95 15.83 78.36 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.772 -0.728 . . . . 74.31 112.468 -179.893 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -85.76 141.36 29.74 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.823 0.344 . . . . 63.41 110.876 -179.957 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -111.8 130.14 55.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.24 -0.436 . . . . 74.21 111.126 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 171' ' ' HIS . . . . . 0.521 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 49.6 m170 -131.24 132.49 44.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.215 -0.448 . . . . 72.53 110.927 -179.966 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 31.8 m-85 -111.52 138.02 48.59 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.208 -0.451 . . . . 71.44 110.859 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 173' ' ' ASP . . . . . 0.403 ' HB2' ' CE1' ' A' ' 149' ' ' PHE . 65.7 t0 -65.28 96.02 0.21 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.193 -0.458 . . . . 74.11 110.82 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.66 -16.16 9.83 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.234 -0.439 . . . . 72.25 110.911 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -79.01 -16.35 57.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.122 -0.49 . . . . 73.32 110.831 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 23.7 mm-40 -84.61 -171.48 3.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.22 -0.445 . . . . 63.2 110.956 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 177' ' ' ARG . . . . . 0.43 ' HG3' ' HA3' ' A' ' 185' ' ' GLY . 0.0 OUTLIER -115.91 118.66 33.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.156 -0.474 . . . . 63.14 110.854 -179.941 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 178' ' ' TRP . . . . . 0.401 ' CE3' ' HB ' ' A' ' 186' ' ' ILE . 45.8 m95 -117.01 144.3 44.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.145 -0.479 . . . . 72.31 110.909 -179.95 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 179' ' ' THR . . . . . 0.508 ' HA ' HD11 ' A' ' 100' ' ' LEU . 12.3 t -178.04 163.65 1.76 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.211 -0.449 . . . . 74.13 111.132 -179.936 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -125.25 -69.7 0.78 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.274 -0.421 . . . . 45.33 110.885 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -63.2 -13.24 48.27 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.788 -0.72 . . . . 62.41 112.478 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 182' ' ' SER . . . . . 0.491 ' HB3' HG21 ' A' ' 179' ' ' THR . 0.3 OUTLIER -93.14 -24.31 18.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.939 0.399 . . . . 64.5 110.85 -179.788 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 86.6 p 37.93 43.74 0.55 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 64.12 110.888 -179.807 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -107.84 -33.54 7.21 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.071 -0.513 . . . . 74.2 110.919 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 185' ' ' GLY . . . . . 0.43 ' HA3' ' HG3' ' A' ' 177' ' ' ARG . . . -112.67 -145.11 9.44 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.711 -0.756 . . . . 73.01 112.525 179.872 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 186' ' ' ILE . . . . . 1.05 HG21 HD21 ' A' ' 156' ' ' LEU . 11.5 mm -78.87 97.8 2.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.9 0.381 . . . . 73.22 111.121 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 22.1 m-80 -44.55 118.17 1.49 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.216 -0.447 . . . . 71.31 110.884 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 188' ' ' PHE . . . . . 0.632 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.4 t80 -53.96 -36.37 62.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.145 -0.479 . . . . 75.45 110.877 179.998 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 189' ' ' LEU . . . . . 0.453 HD21 ' CG ' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -67.18 -47.16 71.76 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.164 -0.471 . . . . 52.02 110.898 -179.932 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 6.2 t80 -69.24 -38.93 78.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.186 -0.461 . . . . 74.22 110.92 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 191' ' ' ALA . . . . . 0.615 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -72.01 -35.83 69.53 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.125 -0.489 . . . . 50.03 111.134 179.837 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 192' ' ' ALA . . . . . 0.615 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -56.98 -45.0 83.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.195 -0.457 . . . . 52.11 111.078 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 193' ' ' THR . . . . . 0.594 HG21 ' HE1' ' A' ' 224' ' ' PHE . 0.3 OUTLIER -58.52 -41.25 85.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.217 -0.447 . . . . 72.43 111.153 -179.919 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 13.7 t-160 -72.77 -45.41 58.72 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.18 -0.464 . . . . 71.44 110.877 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -69.42 -47.41 64.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.206 -0.452 . . . . 71.01 111.095 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 196' ' ' LEU . . . . . 0.75 HD12 ' CD1' ' A' ' 113' ' ' LEU . 4.0 mm? -66.26 -43.18 87.19 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.244 -0.434 . . . . 74.51 110.903 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -60.67 -24.29 61.94 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.79 -0.719 . . . . 52.23 112.472 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 198' ' ' HIS . . . . . 0.652 ' CD2' HG21 ' A' ' 69' ' ' VAL . 5.7 m-70 -68.08 -42.69 80.01 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.807 0.337 . . . . 75.21 110.928 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 199' ' ' SER . . . . . 0.451 ' O ' ' HD3' ' A' ' 162' ' ' PRO . 41.4 t -62.15 -23.3 66.5 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.182 -0.463 . . . . 71.13 110.91 -179.854 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 1.6 mt -85.23 2.58 43.25 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.075 -0.511 . . . . 64.13 110.965 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 84.91 -9.37 66.14 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.817 -0.706 . . . . 50.41 112.434 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 202' ' ' MET . . . . . 0.417 ' CE ' ' HB ' ' A' ' 234' ' ' ILE . 0.0 OUTLIER -57.55 130.47 46.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.782 0.325 . . . . 63.21 110.915 179.962 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -101.03 175.12 25.92 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.777 -0.725 . . . . 64.44 112.451 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 17.3 m-70 -68.09 163.47 22.4 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.766 0.317 . . . . 74.32 110.909 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -127.06 156.36 41.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.228 -0.442 . . . . 53.34 110.899 -179.788 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 5.6 p -87.65 -4.28 58.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.208 -0.451 . . . . 72.22 110.817 -179.75 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 207' ' ' ASP . . . . . 0.469 ' HB2' ' HB2' ' A' ' 210' ' ' ALA . 24.4 m-20 -71.29 133.62 85.3 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-O 121.635 0.731 . . . . 65.11 110.811 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 -6.0 17.55 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.682 2.255 . . . . 74.53 112.297 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 -127.64 26.49 5.91 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.252 -0.431 . . . . 63.52 110.841 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 210' ' ' ALA . . . . . 0.469 ' HB2' ' HB2' ' A' ' 207' ' ' ASP . . . -87.4 145.65 26.21 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.234 -0.439 . . . . 62.23 111.071 179.821 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 211' ' ' VAL . . . . . 0.49 HG21 HG21 ' A' ' 193' ' ' THR . 0.4 OUTLIER -67.49 -27.35 38.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.207 -0.451 . . . . 62.04 111.128 179.959 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 35.6 mmm -93.83 6.13 49.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.454 . . . . 75.22 110.866 179.881 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 213' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -55.91 111.87 3.66 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.666 0.746 . . . . 73.43 110.955 -179.877 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.79 -17.79 37.24 Favored 'Trans proline' 0 C--N 1.341 0.135 0 C-N-CA 122.688 2.259 . . . . 63.01 112.32 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.13 60.48 5.93 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.232 -0.44 . . . . 74.24 111.1 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.367 0 CA-C-N 116.191 -0.459 . . . . 74.14 110.914 -179.923 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 224' ' ' PHE . . . . . 0.594 ' HE1' HG21 ' A' ' 193' ' ' THR . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.903 0.382 . . . . 65.01 110.864 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.86 158.59 43.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.087 -0.506 . . . . 64.24 110.963 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 226' ' ' LEU . . . . . 0.7 ' HB3' HD11 ' A' ' 231' ' ' ILE . 50.4 mt -69.74 148.92 48.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.231 -0.44 . . . . 53.44 110.908 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 227' ' ' SER . . . . . 0.492 ' O ' HD12 ' A' ' 231' ' ' ILE . 0.0 OUTLIER -87.17 148.49 25.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.173 -0.467 . . . . 74.21 110.886 -179.96 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.7 -64.07 0.96 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.158 -0.474 . . . . 74.54 110.919 -179.953 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -55.66 -27.68 51.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.171 -0.468 . . . . 72.22 110.852 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -70.05 -49.36 51.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.157 -0.474 . . . . 74.23 110.857 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 231' ' ' ILE . . . . . 0.7 HD11 ' HB3' ' A' ' 226' ' ' LEU . 8.3 mt -69.39 -44.27 80.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.22 -0.446 . . . . 73.41 111.135 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 1.2 ptmt -56.41 -32.58 64.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.139 -0.482 . . . . 65.42 110.901 179.812 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -64.95 -50.54 57.5 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.791 -0.719 . . . . 63.43 112.464 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 234' ' ' ILE . . . . . 0.497 HD11 ' CE1' ' A' ' 238' ' ' TYR . 8.0 tt -73.82 -31.11 30.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.817 0.342 . . . . 71.54 111.16 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -61.67 -23.7 66.25 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.158 -0.474 . . . . 70.33 110.889 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 236' ' ' LYS . . . . . 0.433 ' HE2' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.39 -24.61 59.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.252 -0.431 . . . . 51.21 110.884 179.947 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 237' ' ' LEU . . . . . 0.748 HD22 ' HD2' ' A' ' 83' ' ' LYS . 9.2 tt -93.02 -30.27 15.4 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.252 -0.431 . . . . 75.41 110.918 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 238' ' ' TYR . . . . . 0.497 ' CE1' HD11 ' A' ' 234' ' ' ILE . 46.9 m-85 -92.27 -35.4 13.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.167 -0.47 . . . . 51.24 110.921 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.26 0 C-N-CA 120.679 -0.772 . . . . 32.22 112.384 -179.954 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 6.6 t-105 . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.679 0.276 . . . . 71.22 110.889 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -73.32 -36.39 66.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.294 -0.412 . . . . 72.51 110.919 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -63.12 -38.09 89.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.158 -0.474 . . . . 61.24 110.851 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.66 ' HB1' ' CE ' ' A' ' 62' ' ' MET . . . -64.23 -43.66 94.27 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.207 -0.451 . . . . 54.34 111.062 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.2 -43.09 99.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.215 -0.448 . . . . 73.12 110.855 -179.89 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -73.66 -31.52 63.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.208 -0.451 . . . . 72.4 110.888 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -70.74 -36.41 73.13 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.23 -0.441 . . . . 75.11 110.89 -179.819 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.686 HD13 ' O ' ' A' ' 19' ' ' LEU . 3.1 tm? -71.91 -21.04 61.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.149 -0.478 . . . . 72.51 110.973 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 5.1 ptmt -74.85 -34.62 62.31 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.156 -0.475 . . . . 74.41 110.918 179.822 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.04 -27.17 48.71 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.212 -0.449 . . . . 74.05 110.875 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -75.42 2.12 12.24 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.207 -0.451 . . . . 74.31 110.916 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.423 ' O ' ' HB2' ' A' ' 70' ' ' PRO . 7.8 m-85 . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.166 -0.47 . . . . 72.55 110.976 -179.842 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.524 HD23 ' N ' ' A' ' 36' ' ' GLU . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.766 0.317 . . . . 72.52 110.895 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.524 ' N ' HD23 ' A' ' 35' ' ' LEU . 0.7 OUTLIER -61.95 -51.05 69.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.244 -0.435 . . . . 73.13 110.944 179.897 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.7 -36.79 85.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.175 -0.466 . . . . 63.32 111.096 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.47 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 1.1 tttp -69.5 -49.16 57.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.191 -0.459 . . . . 72.32 110.869 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.783 HD11 HD22 ' A' ' 54' ' ' LEU . 2.1 mt -61.84 -35.62 78.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.251 -0.431 . . . . 72.11 110.909 179.968 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.74 -45.92 88.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.187 -0.461 . . . . 62.43 110.891 179.799 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.47 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 3.5 pt-20 -62.81 -32.43 73.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.26 -0.427 . . . . 75.11 110.841 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.433 ' HE3' ' CZ ' ' A' ' 46' ' ' PHE . 1.5 ttt -68.05 -34.25 76.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.18 -0.464 . . . . 63.43 110.868 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.479 ' CD ' HD11 ' A' ' 48' ' ' LEU . 2.6 mm100 -57.26 -39.22 75.19 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.265 -0.425 . . . . 74.45 110.983 -179.961 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.4 mmtt -68.78 -28.76 67.07 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.14 -0.482 . . . . 71.43 110.912 179.943 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -70.59 -43.84 68.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 73.32 110.881 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.443 ' CB ' HD23 ' A' ' 48' ' ' LEU . 10.3 m-85 -82.05 -34.92 29.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.157 -0.474 . . . . 70.43 110.873 -179.905 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 102.65 -8.36 54.54 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.785 -0.722 . . . . 64.34 112.575 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.479 HD11 ' CD ' ' A' ' 43' ' ' GLN . 0.9 OUTLIER -59.87 136.43 90.29 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.665 0.745 . . . . 64.11 110.874 -179.916 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.69 -51.8 0.37 Allowed 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.715 2.277 . . . . 74.5 112.369 179.823 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.475 HD12 HG23 ' A' ' 58' ' ' VAL . 0.9 OUTLIER -51.11 108.25 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.219 -0.446 . . . . 71.22 111.102 179.924 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 7.4 p -96.24 156.62 16.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.119 -0.492 . . . . 73.25 111.16 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 58.76 20.22 46.57 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.783 -0.722 . . . . 64.24 112.441 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' MET . . . . . 0.452 ' O ' HG11 ' A' ' 58' ' ' VAL . 28.4 mmt -104.99 142.76 34.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.856 0.36 . . . . 75.23 110.805 -179.919 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.783 HD22 HD11 ' A' ' 39' ' ' LEU . 32.4 tp -161.9 77.91 0.52 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.194 -0.457 . . . . 73.4 110.925 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -179.04 -29.8 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.198 -0.456 . . . . 44.35 110.869 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 26.7 t -91.45 -98.55 0.12 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.206 -0.452 . . . . 75.25 110.842 -179.886 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 11.1 tpt180 -84.8 -31.08 24.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.123 -0.49 . . . . 61.22 110.823 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.475 HG23 HD12 ' A' ' 50' ' ' ILE . 88.9 t -63.94 -43.27 97.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.158 -0.473 . . . . 70.12 111.159 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.445 HD13 ' HA ' ' A' ' 59' ' ' ILE . 0.4 OUTLIER -69.05 -30.83 47.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.12 -0.491 . . . . 74.43 111.188 179.921 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.52 -43.73 93.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.18 -0.464 . . . . 73.45 110.904 179.936 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.731 HG21 HG22 ' A' ' 215' ' ' THR . 0.0 OUTLIER -76.18 -29.82 19.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.092 -0.504 . . . . 74.52 111.123 179.973 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 62' ' ' MET . . . . . 0.66 ' CE ' ' HB1' ' A' ' 15' ' ' ALA . 10.1 mmm -68.91 -26.64 65.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.454 . . . . 74.01 110.84 179.845 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -100.07 -24.99 14.45 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.239 -0.437 . . . . 42.22 110.909 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 6.6 mtmp? -85.27 152.6 58.42 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.533 0.682 . . . . 65.34 110.929 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 152.45 69.35 Favored 'Trans proline' 0 N--CA 1.466 -0.138 0 C-N-CA 122.76 2.307 . . . . 72.11 112.303 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 2.1 ttm180 -147.99 -83.69 0.11 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.201 -0.454 . . . . 71.51 110.853 -179.901 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -145.72 156.57 43.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.184 -0.462 . . . . 55.3 110.882 -179.933 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.708 ' HA2' HG23 ' A' ' 155' ' ' THR . . . -94.98 9.81 70.29 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.704 -0.76 . . . . 64.23 112.51 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.515 HG12 ' HD2' ' A' ' 70' ' ' PRO . 0.2 OUTLIER -100.33 135.38 20.28 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.574 0.702 . . . . 74.23 111.157 -179.973 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 70' ' ' PRO . . . . . 0.515 ' HD2' HG12 ' A' ' 69' ' ' VAL . 53.1 Cg_endo -69.77 159.81 52.0 Favored 'Trans proline' 0 N--CA 1.465 -0.196 0 C-N-CA 122.709 2.273 . . . . 63.44 112.369 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -94.37 6.66 48.05 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.272 -0.422 . . . . 74.45 110.862 179.969 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.159 -0.473 . . . . 53.43 111.137 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo . . . . . 0 C--O 1.231 0.16 0 CA-C-O 120.945 0.31 . . . . 71.11 112.363 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.683 ' HD3' HD22 ' A' ' 237' ' ' LEU . 9.7 mtpt -117.17 148.79 41.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.229 -0.441 . . . . 64.45 110.91 179.846 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' TRP . . . . . 0.545 ' CZ3' HG11 ' A' ' 89' ' ' VAL . 39.2 m0 -47.22 109.49 0.21 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.217 -0.447 . . . . 73.31 110.884 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.0 -5.28 11.97 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.261 -0.427 . . . . 65.3 111.151 -180.0 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -61.83 164.42 6.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 70.34 110.817 -179.844 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 11.5 mmtt -70.91 -30.66 67.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.056 -0.52 . . . . 71.12 110.953 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.422 ' HA ' ' O ' ' A' ' 123' ' ' HIS . 0.3 OUTLIER -154.02 144.92 14.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.258 -0.428 . . . . 74.14 111.092 179.879 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.545 HG11 ' CZ3' ' A' ' 84' ' ' TRP . 5.5 t -130.64 137.51 55.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.206 -0.452 . . . . 72.25 111.165 179.838 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.794 HG22 ' HB3' ' A' ' 125' ' ' ARG . 3.5 p -117.71 167.97 10.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 71.01 111.151 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.446 ' O ' HG21 ' A' ' 127' ' ' VAL . 3.7 p90 -150.05 146.58 27.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.251 -0.431 . . . . 70.51 110.93 -179.956 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.473 ' HB3' ' HB3' ' A' ' 132' ' ' ALA . 5.6 ttt-85 -149.43 139.75 22.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.113 -0.494 . . . . 71.25 110.811 -179.936 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.505 HD11 ' HA ' ' A' ' 106' ' ' ASP . 10.8 mm -74.75 134.47 29.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.144 -0.48 . . . . 72.4 111.176 179.866 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.71 HG22 ' SD ' ' A' ' 135' ' ' MET . 10.7 t -90.03 -40.68 13.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.465 . . . . 60.2 111.137 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 2.5 t -139.63 167.06 22.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.21 -0.45 . . . . 64.24 110.828 -179.813 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 15.6 p90 -114.93 149.96 36.44 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.115 -0.493 . . . . 72.25 110.945 -179.904 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.55 ' OG1' HG21 ' A' ' 105' ' ' VAL . 0.2 OUTLIER -83.22 140.98 32.22 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.114 -0.494 . . . . 64.11 111.113 -179.973 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.33 -8.47 55.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 72.14 110.806 -179.957 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -96.82 -25.61 15.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.252 -0.431 . . . . 74.13 110.818 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.658 HD21 ' HA ' ' A' ' 179' ' ' THR . 0.8 OUTLIER -135.84 153.44 77.18 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.632 0.73 . . . . 72.52 110.9 -179.944 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 101' ' ' PRO . . . . . 0.618 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.4 Cg_endo -69.79 151.12 68.81 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.666 2.244 . . . . 73.11 112.361 179.919 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 5.2 t-160 -53.96 -25.72 22.16 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.234 -0.439 . . . . 74.11 110.868 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.618 HG22 ' HB2' ' A' ' 101' ' ' PRO . 15.1 tt -75.57 -38.33 38.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.212 -0.449 . . . . 74.02 111.15 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 104' ' ' THR . . . . . 0.665 ' O ' HD22 ' A' ' 108' ' ' LEU . 3.1 m -69.2 -39.49 78.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.147 -0.479 . . . . 52.11 111.119 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.751 ' O ' HG13 ' A' ' 109' ' ' VAL . 92.9 t -72.93 -45.41 55.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.214 -0.448 . . . . 71.51 111.143 179.901 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.636 ' O ' HG22 ' A' ' 109' ' ' VAL . 49.8 t0 -61.5 -44.55 96.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.13 -0.486 . . . . 63.44 110.92 179.94 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 1.7 ptm180 -69.93 -33.55 72.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.171 -0.468 . . . . 75.02 110.854 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.665 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -60.64 -49.07 79.02 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.15 -0.477 . . . . 71.04 110.954 -179.97 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.751 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.4 m -55.61 -42.2 67.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.199 -0.455 . . . . 72.31 111.132 179.791 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.472 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 34.9 t -70.19 -34.16 72.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.157 -0.474 . . . . 72.14 110.889 -179.854 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.454 ' CG ' HD21 ' A' ' 189' ' ' LEU . 0.4 OUTLIER -62.56 -33.36 74.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.091 -0.504 . . . . 74.35 110.842 -179.998 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -95.09 -40.9 9.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.26 -0.427 . . . . 74.32 111.085 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.739 ' CD1' HD12 ' A' ' 196' ' ' LEU . 0.4 OUTLIER -65.65 -33.12 75.16 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.254 -0.43 . . . . 72.0 110.914 -179.982 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 29.6 t-20 -64.83 -40.95 96.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.177 -0.465 . . . . 72.34 110.861 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 115' ' ' MET . . . . . 0.72 ' O ' HD11 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -57.8 -34.62 69.83 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.158 -0.473 . . . . 54.12 110.895 179.953 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 9.1 m95 -66.73 -52.36 45.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.186 -0.461 . . . . 75.23 110.887 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 117' ' ' GLY . . . . . 0.457 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -59.96 -37.39 92.59 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.745 -0.74 . . . . 73.32 112.485 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.4 mmpt? -61.82 -16.86 53.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.777 0.322 . . . . 72.42 110.91 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.798 ' HG2' HD13 ' A' ' 226' ' ' LEU . 0.4 OUTLIER -101.01 13.27 35.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.249 -0.432 . . . . 75.24 110.885 179.96 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 0.457 ' CG1' ' HA2' ' A' ' 117' ' ' GLY . 2.2 pt -147.16 146.39 25.4 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.641 0.734 . . . . 71.34 111.156 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.72 6.22 1.38 Allowed 'Trans proline' 0 C--O 1.232 0.225 0 C-N-CA 122.809 2.339 . . . . 72.21 112.318 179.895 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.442 ' HA ' HD23 ' A' ' 122' ' ' LEU . 4.9 mt -62.52 -156.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.223 -0.444 . . . . 73.22 110.963 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 123' ' ' HIS . . . . . 0.422 ' O ' ' HA ' ' A' ' 88' ' ' VAL . 12.3 t-80 -158.67 127.37 5.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.223 -0.444 . . . . 74.12 110.862 179.851 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 11.5 m-30 -110.49 142.85 41.7 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.191 -0.459 . . . . 75.54 110.907 -179.913 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.794 ' HB3' HG22 ' A' ' 90' ' ' THR . 0.0 OUTLIER -117.96 140.17 50.12 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.162 -0.472 . . . . 75.14 110.944 -179.968 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.79 142.18 32.83 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.228 -0.442 . . . . 72.22 110.868 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 127' ' ' VAL . . . . . 0.818 HG11 ' HB2' ' A' ' 132' ' ' ALA . 30.3 m -103.23 140.33 21.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.189 -0.459 . . . . 50.13 111.131 179.852 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.402 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -156.41 -27.54 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.205 -0.452 . . . . 74.43 111.129 179.941 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 129' ' ' TRP . . . . . 0.402 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -135.35 109.2 8.1 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.174 -0.467 . . . . 71.25 110.939 179.994 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.97 -158.52 14.83 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.757 -0.735 . . . . 62.11 112.498 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.9 156.29 17.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.8 0.333 . . . . 63.25 111.13 -179.841 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 132' ' ' ALA . . . . . 0.818 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -111.59 165.46 11.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.172 -0.467 . . . . 51.34 111.096 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -66.38 -62.58 1.39 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.23 -0.441 . . . . 75.41 110.907 179.953 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 134' ' ' ILE . . . . . 0.43 HG22 HD13 ' A' ' 136' ' ' ILE . 4.5 mp -82.72 142.55 13.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.112 -0.494 . . . . 70.51 111.148 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 135' ' ' MET . . . . . 0.71 ' SD ' HG22 ' A' ' 94' ' ' VAL . 27.9 mmt -113.14 119.25 37.18 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.172 -0.467 . . . . 72.43 110.843 179.861 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.438 HG21 HG11 ' A' ' 109' ' ' VAL . 1.0 OUTLIER -105.61 89.91 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.191 -0.459 . . . . 70.04 111.147 179.928 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -129.93 167.92 21.5 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.771 -0.728 . . . . 63.34 112.501 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 138' ' ' PHE . . . . . 0.562 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 32.7 m-85 -104.89 149.96 25.26 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.828 0.347 . . . . 74.01 110.848 -179.845 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.562 ' HB2' ' O ' ' A' ' 138' ' ' PHE . . . 169.59 165.93 0.05 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.158 -0.473 . . . . 71.21 111.08 179.851 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 4.6 ptt85 -109.45 174.27 5.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.227 -0.442 . . . . 62.21 110.908 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 141' ' ' GLY . . . . . 0.498 ' H ' ' HA ' ' A' ' 149' ' ' PHE . . . -55.03 -16.68 8.48 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.695 -0.764 . . . . 74.24 112.528 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 142' ' ' ALA . . . . . 0.502 ' HB2' ' CD2' ' A' ' 149' ' ' PHE . . . -91.45 13.13 18.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.817 0.342 . . . . 75.03 111.115 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 143' ' ' HIS . . . . . 0.467 ' HB3' ' HB1' ' A' ' 139' ' ' ALA . 4.1 p80 -80.52 -0.99 39.98 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.199 -0.455 . . . . 71.11 110.911 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 107.3 45.15 1.18 Allowed Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.719 -0.753 . . . . 45.51 112.408 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 39.9 p-10 -146.05 168.82 20.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.843 0.354 . . . . 72.14 110.877 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.0 164.96 9.62 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.142 -0.481 . . . . 51.25 110.881 -179.744 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 64.73 132.37 0.03 OUTLIER Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.65 0.738 . . . . 73.4 110.916 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.67 151.02 69.47 Favored 'Trans proline' 0 C--O 1.231 0.125 0 C-N-CA 122.715 2.276 . . . . 74.53 112.342 179.951 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 149' ' ' PHE . . . . . 0.502 ' CD2' ' HB2' ' A' ' 142' ' ' ALA . 7.0 p90 -53.94 -41.94 68.28 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.227 -0.442 . . . . 63.52 110.906 179.966 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 76.69 -22.69 0.27 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.118 -0.492 . . . . 63.11 110.861 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 151' ' ' GLY . . . . . 0.434 ' H ' ' C ' ' A' ' 149' ' ' PHE . . . 74.8 -149.55 39.94 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.812 -0.709 . . . . 71.41 112.472 -179.914 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.71 142.35 47.89 Favored 'Trans proline' 0 C--N 1.341 0.137 0 C-N-CA 122.666 2.244 . . . . 75.11 112.349 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 153' ' ' GLY . . . . . 0.448 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 104.34 -139.45 14.58 Favored Glycine 0 N--CA 1.453 -0.197 0 C-N-CA 120.669 -0.777 . . . . 70.32 112.456 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 154' ' ' ASN . . . . . 0.448 ' C ' ' O ' ' A' ' 153' ' ' GLY . 4.0 p30 -34.77 140.93 0.07 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.963 0.411 . . . . 73.25 110.895 -179.871 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 155' ' ' THR . . . . . 0.708 HG23 ' HA2' ' A' ' 68' ' ' GLY . 1.6 m 78.21 107.19 0.07 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.136 -0.484 . . . . 44.41 111.141 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 156' ' ' LEU . . . . . 0.995 HD21 HG21 ' A' ' 186' ' ' ILE . 0.8 OUTLIER -93.8 -54.69 3.52 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.211 -0.449 . . . . 75.02 110.921 179.921 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 157' ' ' ALA . . . . . 0.592 ' HB1' ' O ' ' A' ' 171' ' ' HIS . . . -158.56 148.0 19.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.177 -0.465 . . . . 71.42 111.069 179.843 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 26.5 p-80 -109.67 122.47 47.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.21 -0.45 . . . . 72.02 110.824 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 159' ' ' ALA . . . . . 0.446 ' H ' HG22 ' A' ' 69' ' ' VAL . . . -109.59 160.63 16.09 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.221 -0.445 . . . . 74.42 111.13 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 11.8 m-85 -118.4 156.29 29.23 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.208 -0.451 . . . . 75.31 110.865 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 161' ' ' ALA . . . . . 0.739 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -82.85 165.29 42.42 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.543 0.687 . . . . 61.04 111.127 179.94 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 162' ' ' PRO . . . . . 0.739 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.6 Cg_endo -69.89 67.69 1.8 Allowed 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.668 2.246 . . . . 74.44 112.345 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -127.82 107.11 0.84 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.733 -0.746 . . . . 61.41 112.527 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 164' ' ' THR . . . . . 0.485 HG22 ' H ' ' A' ' 165' ' ' GLY . 0.2 OUTLIER 72.83 174.39 0.29 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.888 0.375 . . . . 73.1 111.119 -179.886 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 165' ' ' GLY . . . . . 0.485 ' H ' HG22 ' A' ' 164' ' ' THR . . . -50.06 -57.59 9.82 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.776 -0.725 . . . . 74.03 112.433 -179.99 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -60.48 -18.03 48.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.895 0.378 . . . . 65.12 110.964 -179.937 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -68.87 146.8 45.5 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.766 -0.731 . . . . 43.43 112.55 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 81.33 11.78 82.94 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.751 -0.738 . . . . 74.31 112.487 -179.871 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 57.6 m-20 -79.8 148.83 31.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.848 0.356 . . . . 63.41 110.802 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.26 130.41 55.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.148 -0.478 . . . . 74.21 111.084 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 171' ' ' HIS . . . . . 0.592 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 20.6 m170 -126.86 132.4 50.96 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.218 -0.446 . . . . 72.53 110.911 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 32.2 m-85 -113.7 139.56 48.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.268 -0.424 . . . . 71.44 110.841 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 55.0 t0 -71.63 100.69 2.35 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.129 -0.487 . . . . 74.11 110.809 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.71 -16.73 11.86 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.223 -0.444 . . . . 72.25 110.937 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -77.99 -16.26 58.27 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.104 -0.498 . . . . 73.32 110.911 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -85.05 -174.39 5.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.157 -0.474 . . . . 63.2 110.864 -179.873 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 6.4 mtt85 -112.33 115.14 28.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.156 -0.474 . . . . 63.14 110.85 -179.882 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 58.9 m95 -115.97 138.5 51.14 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.153 -0.476 . . . . 72.31 110.882 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 179' ' ' THR . . . . . 0.658 ' HA ' HD21 ' A' ' 100' ' ' LEU . 7.3 t -176.87 163.57 2.25 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.241 -0.436 . . . . 74.13 111.175 -179.974 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -125.06 -68.71 0.83 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.277 -0.419 . . . . 45.33 110.84 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -65.14 -11.68 52.59 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.757 -0.735 . . . . 62.41 112.479 -179.9 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 182' ' ' SER . . . . . 0.524 ' HB3' HG21 ' A' ' 179' ' ' THR . 0.3 OUTLIER -95.38 -24.24 16.8 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.845 0.355 . . . . 64.5 110.84 -179.698 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 183' ' ' SER . . . . . 0.429 ' C ' ' O ' ' A' ' 182' ' ' SER . 89.9 p 34.97 58.87 0.73 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.086 -0.506 . . . . 64.12 110.869 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 2.2 tp -116.73 -33.67 4.74 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.105 -0.498 . . . . 74.2 110.887 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -119.58 -138.41 5.71 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.754 -0.736 . . . . 73.01 112.489 179.915 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 186' ' ' ILE . . . . . 0.995 HG21 HD21 ' A' ' 156' ' ' LEU . 6.1 mm -79.51 98.75 3.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.897 0.379 . . . . 73.22 111.142 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -46.65 127.25 9.37 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.132 -0.486 . . . . 71.31 110.886 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 188' ' ' PHE . . . . . 0.718 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.2 t80 -60.66 -37.39 81.42 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.217 -0.447 . . . . 75.45 110.93 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 189' ' ' LEU . . . . . 0.454 HD21 ' CG ' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -66.7 -47.89 70.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.129 -0.487 . . . . 52.02 110.933 179.942 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 48.8 t80 -69.7 -38.57 77.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.464 . . . . 74.22 110.948 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 191' ' ' ALA . . . . . 0.643 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -72.88 -35.91 67.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.085 -0.507 . . . . 50.03 111.068 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 192' ' ' ALA . . . . . 0.692 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -57.26 -45.23 84.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.194 -0.457 . . . . 52.11 111.057 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 193' ' ' THR . . . . . 0.593 HG21 ' HE1' ' A' ' 224' ' ' PHE . 0.2 OUTLIER -58.39 -41.94 86.0 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.159 -0.473 . . . . 72.43 111.167 -179.883 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 4.9 t60 -72.71 -45.56 58.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.199 -0.455 . . . . 71.44 110.853 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -68.02 -47.96 67.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.202 -0.454 . . . . 71.01 111.079 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 196' ' ' LEU . . . . . 0.739 HD12 ' CD1' ' A' ' 113' ' ' LEU . 4.4 mm? -63.71 -37.32 86.92 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.199 -0.455 . . . . 74.51 110.954 -179.929 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -61.97 -26.46 67.33 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.783 -0.723 . . . . 52.23 112.541 179.855 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 198' ' ' HIS . . . . . 0.493 ' CD2' HG21 ' A' ' 69' ' ' VAL . 6.1 m-70 -68.83 -42.87 76.61 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.753 0.311 . . . . 75.21 110.84 -179.969 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.18 -27.59 65.82 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.452 . . . . 71.13 110.888 -179.765 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -84.78 0.17 51.66 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.041 -0.527 . . . . 64.13 110.938 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 88.36 -9.37 75.65 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.697 -0.764 . . . . 50.41 112.444 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 202' ' ' MET . . . . . 0.464 ' CE ' ' HB ' ' A' ' 234' ' ' ILE . 0.4 OUTLIER -60.33 127.14 30.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.838 0.352 . . . . 63.21 110.886 -179.995 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -101.03 178.86 28.44 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.781 -0.724 . . . . 64.44 112.486 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 17.2 m80 -68.94 159.65 32.29 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.821 0.343 . . . . 74.32 110.86 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -122.25 157.36 31.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.204 -0.453 . . . . 53.34 110.807 -179.764 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -87.88 -4.43 58.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.084 -0.507 . . . . 72.22 110.863 -179.827 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.44 137.49 83.68 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.681 0.753 . . . . 65.11 110.871 179.943 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 -6.68 19.17 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.694 2.263 . . . . 74.53 112.348 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 -127.61 33.48 4.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.213 -0.449 . . . . 63.52 110.896 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 210' ' ' ALA . . . . . 0.51 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.14 145.99 26.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.156 -0.475 . . . . 62.23 111.104 179.851 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -73.47 -26.86 22.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.213 -0.449 . . . . 62.04 111.2 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 212' ' ' MET . . . . . 0.451 ' HE1' ' HB2' ' A' ' 202' ' ' MET . 16.3 tpp -94.76 6.94 47.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.14 -0.482 . . . . 75.22 110.846 179.953 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 213' ' ' TYR . . . . . 0.429 ' HB2' ' O ' ' A' ' 210' ' ' ALA . 0.1 OUTLIER -56.2 127.32 70.21 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.703 0.763 . . . . 73.43 110.929 -179.857 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.77 -29.57 23.63 Favored 'Trans proline' 0 C--O 1.231 0.159 0 C-N-CA 122.687 2.258 . . . . 63.01 112.357 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 215' ' ' THR . . . . . 0.731 HG22 HG21 ' A' ' 61' ' ' ILE . 60.4 p -84.42 62.23 7.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.214 -0.448 . . . . 74.24 111.205 179.964 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.247 -0.433 . . . . 74.14 110.906 -179.909 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 224' ' ' PHE . . . . . 0.593 ' HE1' HG21 ' A' ' 193' ' ' THR . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.863 0.363 . . . . 65.01 110.901 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -143.6 159.24 42.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.153 -0.476 . . . . 64.24 110.964 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 226' ' ' LEU . . . . . 0.798 HD13 ' HG2' ' A' ' 119' ' ' GLU . 29.9 mt -65.5 148.79 51.14 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.286 -0.415 . . . . 53.44 110.924 179.93 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 227' ' ' SER . . . . . 0.51 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 1.8 t -87.65 151.71 22.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.216 -0.447 . . . . 74.21 110.83 -179.922 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.54 -63.0 1.15 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.115 -0.493 . . . . 74.54 110.89 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -55.7 -27.47 50.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.163 -0.471 . . . . 72.22 110.842 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -70.58 -49.41 48.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.279 -0.418 . . . . 74.23 110.885 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 231' ' ' ILE . . . . . 0.707 HD11 ' HB3' ' A' ' 226' ' ' LEU . 9.5 mt -69.34 -45.03 79.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 73.41 111.101 179.972 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.21 -33.18 67.25 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.238 -0.437 . . . . 65.42 110.867 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -63.12 -49.49 71.09 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.81 -0.709 . . . . 63.43 112.467 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 234' ' ' ILE . . . . . 0.555 HD11 ' CE1' ' A' ' 238' ' ' TYR . 6.8 tt -72.59 -29.1 29.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.814 0.34 . . . . 71.54 111.16 180.0 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -60.23 -28.51 68.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.159 -0.473 . . . . 70.33 110.944 179.945 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 236' ' ' LYS . . . . . 0.442 ' HD3' ' N ' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.67 -27.3 60.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.241 -0.436 . . . . 51.21 110.92 179.915 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 237' ' ' LEU . . . . . 0.683 HD22 ' HD3' ' A' ' 83' ' ' LYS . 8.2 tt -97.48 -24.59 15.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.213 -0.449 . . . . 75.41 110.936 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 238' ' ' TYR . . . . . 0.555 ' CE1' HD11 ' A' ' 234' ' ' ILE . 3.8 m-85 -92.31 -35.38 13.78 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.452 . . . . 51.24 110.925 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.328 0 C-N-CA 120.763 -0.732 . . . . 32.22 112.475 179.993 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 15.2 t-105 . . . . . 0 C--O 1.23 0.029 0 CA-C-O 120.742 0.306 . . . . 71.22 110.958 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -73.27 -35.26 66.15 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.236 -0.438 . . . . 72.51 110.825 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.98 -39.26 94.18 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.205 -0.452 . . . . 61.24 110.864 -179.876 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.22 -35.13 69.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.174 -0.466 . . . . 54.34 111.069 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.488 ' NE2' HD12 ' A' ' 35' ' ' LEU . 0.0 OUTLIER -67.31 -40.07 85.97 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.251 -0.431 . . . . 73.12 110.896 -179.899 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -77.18 -31.71 55.61 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.191 -0.459 . . . . 72.4 110.873 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -62.73 -36.16 82.09 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.185 -0.461 . . . . 75.11 110.926 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.745 HD13 ' O ' ' A' ' 19' ' ' LEU . 1.8 tm? -71.38 -21.04 62.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.124 -0.489 . . . . 72.51 110.896 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 4.4 ptmt -74.8 -29.81 61.22 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.206 -0.452 . . . . 74.41 110.928 179.829 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.6 ptp85 -86.59 -28.03 23.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.205 -0.452 . . . . 74.05 110.905 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 13.0 m-85 -68.82 -10.66 58.05 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.157 -0.474 . . . . 74.31 110.814 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.526 ' HB3' HG21 ' A' ' 72' ' ' VAL . 8.3 m-85 . . . . . 0 C--N 1.328 -0.362 0 CA-C-N 116.197 -0.456 . . . . 72.55 110.92 -179.852 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.488 HD12 ' NE2' ' A' ' 16' ' ' GLN . 2.3 tt . . . . . 0 N--CA 1.458 -0.066 0 CA-C-O 120.837 0.351 . . . . 72.52 110.982 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.415 ' N ' HD23 ' A' ' 35' ' ' LEU . 0.1 OUTLIER -64.09 -51.22 65.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.184 -0.462 . . . . 73.13 110.872 179.935 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.5 -51.04 68.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.076 -0.511 . . . . 63.32 111.138 179.898 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.521 ' HD3' HD12 ' A' ' 19' ' ' LEU . 5.9 tttp -59.94 -49.35 78.03 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.222 -0.445 . . . . 72.32 110.891 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.42 ' O ' ' HG2' ' A' ' 43' ' ' GLN . 0.1 OUTLIER -58.04 -36.4 72.69 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.261 -0.427 . . . . 72.11 110.909 179.922 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.2 tttm -58.99 -45.7 90.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.151 -0.477 . . . . 62.43 110.847 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.484 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 3.2 pt-20 -60.58 -32.62 71.72 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.226 -0.443 . . . . 75.11 110.905 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 7.5 ttt -68.37 -33.99 75.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.197 -0.456 . . . . 63.43 110.892 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.767 ' OE1' HD11 ' A' ' 48' ' ' LEU . 1.3 mm-40 -61.33 -39.66 91.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.242 -0.435 . . . . 74.45 110.964 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.2 mmpt? -72.39 -32.97 66.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 71.43 110.862 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 56.3 t80 -70.63 -40.68 72.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.181 -0.463 . . . . 73.32 110.839 180.0 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.863 ' CZ ' HD13 ' A' ' 61' ' ' ILE . 3.3 m-85 -82.25 -35.16 28.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.185 -0.462 . . . . 70.43 110.819 -179.829 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 104.05 -10.17 51.34 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.784 -0.722 . . . . 64.34 112.489 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.767 HD11 ' OE1' ' A' ' 43' ' ' GLN . 0.8 OUTLIER -60.11 138.13 91.24 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.518 0.675 . . . . 64.11 110.936 -179.93 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.502 ' O ' HG23 ' A' ' 51' ' ' THR . 53.9 Cg_endo -69.77 -53.55 0.26 Allowed 'Trans proline' 0 C--O 1.231 0.151 0 C-N-CA 122.713 2.276 . . . . 74.5 112.35 179.853 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.508 ' CD1' HG23 ' A' ' 58' ' ' VAL . 0.9 OUTLIER -51.9 108.25 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 71.22 111.196 179.934 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.721 HG22 ' CB ' ' A' ' 43' ' ' GLN . 39.8 p -113.96 151.5 32.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.155 -0.475 . . . . 73.25 111.149 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 76.46 -0.61 63.84 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.756 -0.735 . . . . 64.24 112.528 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' MET . . . . . 0.511 ' O ' HG21 ' A' ' 58' ' ' VAL . 2.9 mtt -135.22 161.08 36.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.836 0.35 . . . . 75.23 110.892 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.72 ' CD1' HD13 ' A' ' 59' ' ' ILE . 2.8 pp -156.78 128.63 7.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.271 -0.422 . . . . 73.4 110.882 -179.945 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.4 t30 173.01 -28.67 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.165 -0.471 . . . . 44.35 110.836 179.816 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 23.1 p -96.85 -87.09 0.32 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.216 -0.447 . . . . 75.25 110.856 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.701 ' O ' HG23 ' A' ' 61' ' ' ILE . 0.1 OUTLIER -84.49 -34.77 23.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.187 -0.46 . . . . 61.22 110.864 -179.972 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.527 ' O ' HG13 ' A' ' 61' ' ' ILE . 14.1 t -59.94 -46.92 93.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.224 -0.444 . . . . 70.12 111.143 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.72 HD13 ' CD1' ' A' ' 54' ' ' LEU . 4.0 tp -75.61 -32.14 24.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.165 -0.471 . . . . 74.43 111.099 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -59.92 -44.24 94.42 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.208 -0.451 . . . . 73.45 110.884 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.863 HD13 ' CZ ' ' A' ' 46' ' ' PHE . 1.7 pp -67.94 -29.52 45.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.225 -0.443 . . . . 74.52 111.098 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 4.7 mmt -61.68 -39.16 90.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.192 -0.458 . . . . 74.01 110.806 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -90.26 -26.29 20.13 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.275 -0.421 . . . . 42.22 110.935 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 4.1 mtmp? -85.21 133.95 41.73 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.573 0.701 . . . . 65.34 110.864 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.7 149.85 67.83 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.69 2.26 . . . . 72.11 112.368 179.84 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.31 -78.63 0.2 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.198 -0.455 . . . . 71.51 110.875 -179.934 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 16.0 p -145.29 141.51 28.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.186 -0.461 . . . . 55.3 110.852 -179.931 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.573 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -90.32 17.2 55.16 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.768 -0.729 . . . . 64.23 112.518 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.686 HG12 ' HD2' ' A' ' 70' ' ' PRO . 0.0 OUTLIER -110.52 141.19 23.48 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.556 0.693 . . . . 74.23 111.154 -179.955 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 70' ' ' PRO . . . . . 0.686 ' HD2' HG12 ' A' ' 69' ' ' VAL . 53.7 Cg_endo -69.75 -179.86 3.2 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.615 2.21 . . . . 63.44 112.367 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -139.33 27.33 2.32 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.211 -0.449 . . . . 74.45 110.902 179.917 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.526 HG21 ' HB3' ' A' ' 23' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 116.207 -0.451 . . . . 53.43 111.128 -179.943 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo . . . . . 0 C--O 1.232 0.213 0 CA-C-O 120.831 0.263 . . . . 71.11 112.362 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.738 ' CD ' HD22 ' A' ' 237' ' ' LEU . 0.0 OUTLIER -140.07 -178.47 5.47 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.237 -0.438 . . . . 64.45 110.898 179.865 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 84' ' ' TRP . . . . . 0.7 ' CE3' HG21 ' A' ' 89' ' ' VAL . 38.1 m0 -59.11 109.77 0.92 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 73.31 110.958 179.926 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 12.0 t -104.49 -14.87 15.53 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.289 -0.414 . . . . 65.3 111.092 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -56.76 152.45 12.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.261 -0.427 . . . . 70.34 110.87 -179.867 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.95 -30.58 71.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.163 -0.471 . . . . 71.12 110.875 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -156.94 144.12 10.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.28 -0.418 . . . . 74.14 111.122 179.86 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.7 HG21 ' CE3' ' A' ' 84' ' ' TRP . 64.7 t -124.36 138.99 52.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.192 -0.458 . . . . 72.25 111.131 179.884 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.676 HG22 ' HB3' ' A' ' 125' ' ' ARG . 1.1 p -115.83 151.14 35.81 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.159 -0.473 . . . . 71.01 111.127 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 5.4 p90 -133.11 146.55 51.71 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.218 -0.447 . . . . 70.51 110.939 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -148.29 138.17 22.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.102 -0.499 . . . . 71.25 110.832 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.421 HD11 ' HA ' ' A' ' 106' ' ' ASP . 11.7 mm -77.59 135.18 26.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.167 -0.47 . . . . 72.4 111.141 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.458 ' HB ' ' HA3' ' A' ' 137' ' ' GLY . 15.3 t -91.37 -40.5 12.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.173 -0.467 . . . . 60.2 111.14 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 3.8 t -141.44 169.44 17.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.145 -0.479 . . . . 64.24 110.859 -179.755 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 12.2 p90 -117.27 150.34 38.95 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.177 -0.465 . . . . 72.25 110.94 -179.891 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.54 ' OG1' HG21 ' A' ' 105' ' ' VAL . 0.2 OUTLIER -82.87 141.06 32.53 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.145 -0.48 . . . . 64.11 111.17 -179.986 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 2.0 ptt180 -72.42 -8.07 53.09 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.207 -0.451 . . . . 72.14 110.852 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -96.63 -25.94 15.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.218 -0.446 . . . . 74.13 110.801 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.5 HD22 HG21 ' A' ' 104' ' ' THR . 0.7 OUTLIER -135.54 152.67 76.78 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.675 0.75 . . . . 72.52 110.902 -179.974 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 101' ' ' PRO . . . . . 0.599 ' HB2' HG22 ' A' ' 103' ' ' ILE . 54.1 Cg_endo -69.69 151.04 69.41 Favored 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.706 2.271 . . . . 73.11 112.336 179.915 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 6.0 t-160 -52.91 -25.71 12.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.191 -0.459 . . . . 74.11 110.884 179.877 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.599 HG22 ' HB2' ' A' ' 101' ' ' PRO . 13.9 tt -76.74 -39.14 31.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.223 -0.444 . . . . 74.02 111.153 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 104' ' ' THR . . . . . 0.647 ' O ' HD22 ' A' ' 108' ' ' LEU . 3.4 m -69.07 -40.06 78.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 52.11 111.179 179.938 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.746 HG13 ' CZ ' ' A' ' 188' ' ' PHE . 90.7 t -72.99 -45.35 55.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.213 -0.449 . . . . 71.51 111.137 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.625 ' O ' HG22 ' A' ' 109' ' ' VAL . 48.1 t0 -61.3 -45.11 95.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.164 -0.471 . . . . 63.44 110.835 179.873 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 4.7 ptm85 -69.71 -33.31 72.32 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.196 -0.457 . . . . 75.02 110.902 -179.873 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.647 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -60.38 -48.72 80.53 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.241 -0.436 . . . . 71.04 110.911 179.957 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.732 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.2 m -55.44 -41.89 64.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.173 -0.467 . . . . 72.31 111.104 179.824 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.471 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 47.2 t -70.0 -34.35 73.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.204 -0.453 . . . . 72.14 110.838 -179.787 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.456 ' CG ' HD21 ' A' ' 189' ' ' LEU . 0.4 OUTLIER -62.51 -33.4 74.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.186 -0.461 . . . . 74.35 110.906 179.939 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.416 ' CB ' ' HB3' ' A' ' 192' ' ' ALA . . . -93.27 -40.61 10.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.206 -0.452 . . . . 74.32 111.061 179.846 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.743 ' CD1' HD12 ' A' ' 196' ' ' LEU . 0.7 OUTLIER -64.85 -33.35 75.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.232 -0.44 . . . . 72.0 110.928 -179.937 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -67.31 -40.99 86.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.233 -0.44 . . . . 72.34 110.882 179.88 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 115' ' ' MET . . . . . 0.768 ' O ' HD11 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -57.93 -34.35 69.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.184 -0.462 . . . . 54.12 110.921 179.89 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 116' ' ' TRP . . . . . 0.451 ' O ' HG12 ' A' ' 120' ' ' ILE . 6.5 m95 -64.84 -49.6 69.95 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.172 -0.467 . . . . 75.23 110.938 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 117' ' ' GLY . . . . . 0.604 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -73.02 -24.92 74.96 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.801 -0.714 . . . . 73.32 112.468 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.444 ' HE3' ' HA ' ' A' ' 115' ' ' MET . 0.3 OUTLIER -64.52 -13.95 54.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.736 0.303 . . . . 72.42 110.921 -179.985 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.578 ' CD ' HG21 ' A' ' 231' ' ' ILE . 1.7 mm-40 -112.61 13.91 20.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.181 -0.463 . . . . 75.24 110.953 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 0.692 ' CD1' HD12 ' A' ' 122' ' ' LEU . 5.0 pt -148.25 150.08 33.78 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.679 0.752 . . . . 71.34 111.161 179.975 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 24.51 0.18 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.658 2.239 . . . . 72.21 112.377 179.872 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.692 HD12 ' CD1' ' A' ' 120' ' ' ILE . 8.3 mt -70.95 -155.03 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.107 -0.497 . . . . 73.22 110.92 179.938 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 123' ' ' HIS . . . . . 0.404 ' H ' ' HB3' ' A' ' 122' ' ' LEU . 5.0 t-80 -172.53 121.51 0.42 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.136 -0.484 . . . . 74.12 110.871 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.9 m-85 -106.97 141.79 37.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.261 -0.427 . . . . 75.54 110.876 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.676 ' HB3' HG22 ' A' ' 90' ' ' THR . 0.0 OUTLIER -115.24 141.17 48.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.191 -0.459 . . . . 75.14 110.897 -179.931 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.88 140.09 35.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.153 -0.476 . . . . 72.22 110.864 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 127' ' ' VAL . . . . . 0.913 HG11 ' HB2' ' A' ' 132' ' ' ALA . 32.7 m -103.06 138.29 27.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.205 -0.452 . . . . 50.13 111.132 179.866 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.409 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -153.47 -27.66 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.166 -0.47 . . . . 74.43 111.107 179.966 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 129' ' ' TRP . . . . . 0.409 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -134.5 109.26 8.6 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.1 -0.5 . . . . 71.25 110.932 179.95 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.39 -160.5 14.05 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.737 -0.744 . . . . 62.11 112.538 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -101.83 155.64 18.01 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.829 0.347 . . . . 63.25 111.165 -179.883 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 132' ' ' ALA . . . . . 0.913 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -112.22 165.28 12.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.216 -0.447 . . . . 51.34 111.061 179.932 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -73.11 -57.03 4.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 75.41 110.834 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 134' ' ' ILE . . . . . 0.708 HG23 ' O ' ' A' ' 168' ' ' GLY . 7.0 mm -82.5 112.79 20.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.189 -0.459 . . . . 70.51 111.102 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 2.0 mmm -96.63 116.6 29.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.115 -0.493 . . . . 72.43 110.903 179.86 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.402 ' O ' HG23 ' A' ' 93' ' ' ILE . 0.8 OUTLIER -106.21 94.64 3.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.238 -0.437 . . . . 70.04 111.096 179.951 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 137' ' ' GLY . . . . . 0.458 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -134.31 169.46 23.02 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.748 -0.739 . . . . 63.34 112.514 179.856 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 138' ' ' PHE . . . . . 0.544 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 2.8 m-85 -105.13 149.83 25.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.847 0.356 . . . . 74.01 110.844 -179.864 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.544 ' HB2' ' O ' ' A' ' 138' ' ' PHE . . . 171.36 167.71 0.08 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.071 -0.513 . . . . 71.21 111.04 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.446 ' HB3' ' HB3' ' A' ' 149' ' ' PHE . 35.1 mtp180 -103.95 173.04 6.47 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.188 -0.46 . . . . 62.21 110.855 -179.883 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -57.34 -16.23 19.74 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.682 -0.77 . . . . 74.24 112.553 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -94.52 13.34 24.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.804 0.335 . . . . 75.03 111.075 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 143' ' ' HIS . . . . . 0.465 ' HB3' ' HB1' ' A' ' 139' ' ' ALA . 9.2 p80 -71.49 -9.35 58.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 71.11 110.854 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 116.9 50.03 0.41 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.739 -0.743 . . . . 45.51 112.458 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -162.56 170.7 18.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.851 0.358 . . . . 72.14 110.851 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -64.11 175.86 1.15 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.129 -0.487 . . . . 51.25 110.836 -179.719 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 11.2 m-85 64.37 119.36 0.02 OUTLIER Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.634 0.731 . . . . 73.4 110.95 -179.854 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.69 151.76 69.55 Favored 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.702 2.268 . . . . 74.53 112.327 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 149' ' ' PHE . . . . . 0.446 ' HB3' ' HB3' ' A' ' 140' ' ' ARG . 8.2 p90 -53.44 -42.7 67.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 63.52 110.867 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 75.55 -22.03 0.28 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.187 -0.46 . . . . 63.11 110.888 179.994 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 151' ' ' GLY . . . . . 0.444 ' H ' ' C ' ' A' ' 149' ' ' PHE . . . 75.64 -156.11 47.63 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.766 -0.731 . . . . 71.41 112.486 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -69.7 142.45 48.22 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.717 2.278 . . . . 75.11 112.362 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 153' ' ' GLY . . . . . 0.443 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 104.52 -137.27 13.52 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.719 -0.753 . . . . 70.32 112.466 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 154' ' ' ASN . . . . . 0.443 ' C ' ' O ' ' A' ' 153' ' ' GLY . 9.7 p30 -35.03 144.38 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.981 0.419 . . . . 73.25 110.919 -179.923 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 155' ' ' THR . . . . . 0.48 HG23 ' HA2' ' A' ' 68' ' ' GLY . 0.2 OUTLIER 73.49 106.75 0.07 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.178 -0.465 . . . . 44.41 111.119 -179.999 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 156' ' ' LEU . . . . . 0.987 HD21 HG21 ' A' ' 186' ' ' ILE . 0.6 OUTLIER -87.87 -55.16 3.88 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.2 -0.455 . . . . 75.02 110.873 179.962 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 157' ' ' ALA . . . . . 0.573 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -163.68 148.24 10.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.203 -0.453 . . . . 71.42 111.162 179.764 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 23.8 p-80 -107.01 128.95 54.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.234 -0.439 . . . . 72.02 110.912 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -109.84 160.33 16.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.195 -0.457 . . . . 74.42 111.078 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 10.7 m-30 -106.59 141.66 37.52 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.231 -0.441 . . . . 75.31 110.919 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 161' ' ' ALA . . . . . 0.687 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -73.85 163.48 68.08 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.57 0.7 . . . . 61.04 111.064 179.979 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 162' ' ' PRO . . . . . 0.687 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 52.8 Cg_endo -69.82 76.15 1.19 Allowed 'Trans proline' 0 C--N 1.341 0.136 0 C-N-CA 122.704 2.269 . . . . 74.44 112.31 -179.943 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -127.46 100.6 0.55 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.725 -0.75 . . . . 61.41 112.445 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 1.3 p 60.21 176.83 0.09 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.856 0.36 . . . . 73.1 111.144 -179.882 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -52.29 -47.94 54.86 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.733 -0.746 . . . . 74.03 112.439 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.17 -19.67 55.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.884 0.373 . . . . 65.12 110.925 -179.893 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -84.71 168.88 44.15 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.768 -0.729 . . . . 43.43 112.482 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 168' ' ' GLY . . . . . 0.708 ' O ' HG23 ' A' ' 134' ' ' ILE . . . 74.6 16.79 80.0 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.711 -0.757 . . . . 74.31 112.453 -179.916 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -77.33 150.2 35.21 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.818 0.342 . . . . 63.41 110.896 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.67 129.97 56.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.215 -0.448 . . . . 74.21 111.079 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 171' ' ' HIS . . . . . 0.528 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 28.6 m170 -131.3 132.32 44.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.229 -0.442 . . . . 72.53 110.883 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 51.4 m-85 -117.72 139.38 51.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.166 -0.47 . . . . 71.44 110.903 -179.891 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 59.0 t0 -71.35 98.86 1.85 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.164 -0.471 . . . . 74.11 110.88 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 1.7 pp20? -57.7 -16.33 10.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.225 -0.443 . . . . 72.25 110.859 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -78.95 -16.35 57.07 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.161 -0.472 . . . . 73.32 110.84 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 -82.11 -176.06 5.96 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.259 -0.428 . . . . 63.2 110.973 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 177' ' ' ARG . . . . . 0.436 ' HG3' ' HA3' ' A' ' 185' ' ' GLY . 4.3 ptp180 -116.82 111.86 20.31 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.219 -0.446 . . . . 63.14 110.944 -179.989 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 5.1 m95 -117.29 152.27 35.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.172 -0.467 . . . . 72.31 110.944 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 179' ' ' THR . . . . . 0.427 ' HA ' HD11 ' A' ' 100' ' ' LEU . 7.8 t 178.41 163.7 0.73 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.27 -0.423 . . . . 74.13 111.142 -179.958 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -120.55 -75.09 0.59 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.21 -0.45 . . . . 45.33 110.892 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -56.13 -20.18 26.91 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.721 -0.752 . . . . 62.41 112.486 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 182' ' ' SER . . . . . 0.447 ' O ' ' C ' ' A' ' 183' ' ' SER . 0.4 OUTLIER -90.9 -24.7 20.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.963 0.411 . . . . 64.5 110.935 -179.802 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 183' ' ' SER . . . . . 0.447 ' C ' ' O ' ' A' ' 182' ' ' SER . 12.9 p 34.45 47.96 0.25 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.06 -0.518 . . . . 64.12 110.873 -179.806 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 3.6 tp -105.42 -33.71 8.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.102 -0.499 . . . . 74.2 110.981 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 185' ' ' GLY . . . . . 0.436 ' HA3' ' HG3' ' A' ' 177' ' ' ARG . . . -114.39 -141.82 7.79 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.763 -0.732 . . . . 73.01 112.504 179.922 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 186' ' ' ILE . . . . . 0.987 HG21 HD21 ' A' ' 156' ' ' LEU . 10.5 mm -78.82 97.58 2.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.888 0.375 . . . . 73.22 111.134 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -46.57 119.5 2.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.168 -0.469 . . . . 71.31 110.838 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 188' ' ' PHE . . . . . 0.746 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 2.4 t80 -54.19 -36.46 63.45 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.474 . . . . 75.45 110.898 179.975 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 189' ' ' LEU . . . . . 0.456 HD21 ' CG ' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -67.11 -47.47 71.04 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.137 -0.483 . . . . 52.02 110.925 -179.965 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 58.3 t80 -69.07 -37.04 78.29 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.201 -0.454 . . . . 74.22 110.973 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 191' ' ' ALA . . . . . 0.579 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -72.81 -35.57 67.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.085 -0.507 . . . . 50.03 111.126 179.884 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 192' ' ' ALA . . . . . 0.679 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -56.73 -44.84 82.06 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.217 -0.447 . . . . 52.11 111.131 179.847 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 193' ' ' THR . . . . . 0.551 HG21 ' HE1' ' A' ' 224' ' ' PHE . 0.7 OUTLIER -58.65 -41.89 87.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.168 -0.469 . . . . 72.43 111.161 -179.892 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 2.6 t60 -72.83 -40.61 65.61 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.236 -0.438 . . . . 71.44 110.8 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -73.42 -47.44 41.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.181 -0.463 . . . . 71.01 111.061 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 196' ' ' LEU . . . . . 0.743 HD12 ' CD1' ' A' ' 113' ' ' LEU . 4.4 mm? -64.2 -43.42 95.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.211 -0.45 . . . . 74.51 110.942 -179.958 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -57.44 -28.2 59.12 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.706 -0.759 . . . . 52.23 112.473 179.907 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 198' ' ' HIS . . . . . . . . . . . . . 4.7 m-70 -66.5 -44.26 83.07 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.827 0.346 . . . . 75.21 110.871 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.42 -25.86 64.69 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.207 -0.451 . . . . 71.13 110.891 -179.824 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 1.5 mt -82.22 -3.07 54.33 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.161 -0.472 . . . . 64.13 110.879 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 88.96 -5.64 84.36 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.807 -0.711 . . . . 50.41 112.565 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 202' ' ' MET . . . . . 0.438 ' SD ' HD12 ' A' ' 234' ' ' ILE . 2.2 mtp -61.93 134.97 57.34 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.815 0.34 . . . . 63.21 110.907 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -101.17 177.11 27.32 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.787 -0.721 . . . . 64.44 112.494 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 17.9 m-70 -70.26 160.76 31.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.782 0.325 . . . . 74.32 110.868 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 205' ' ' SER . . . . . 0.476 ' OG ' ' HB1' ' A' ' 210' ' ' ALA . 0.0 OUTLIER -121.39 151.72 39.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.194 -0.457 . . . . 53.34 110.827 -179.768 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 2.0 p -87.73 -4.63 58.89 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.178 -0.465 . . . . 72.22 110.818 -179.834 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.83 137.9 82.63 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.646 0.736 . . . . 65.11 110.791 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 -7.61 21.49 Favored 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.641 2.227 . . . . 74.53 112.311 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -126.08 29.79 5.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.26 -0.427 . . . . 63.52 110.862 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 210' ' ' ALA . . . . . 0.476 ' HB1' ' OG ' ' A' ' 205' ' ' SER . . . -87.34 145.76 26.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.123 -0.489 . . . . 62.23 111.112 179.878 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -69.69 -28.57 37.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.185 -0.461 . . . . 62.04 111.08 -179.929 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 14.0 tpp -96.48 10.49 38.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.177 -0.465 . . . . 75.22 110.953 179.884 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 213' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -55.69 115.05 8.5 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.629 0.728 . . . . 73.43 110.862 -179.791 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.78 -18.11 37.12 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.661 2.24 . . . . 63.01 112.353 179.878 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 215' ' ' THR . . . . . 0.477 HG23 ' CG2' ' A' ' 61' ' ' ILE . 0.3 OUTLIER -84.2 52.95 2.46 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.254 -0.43 . . . . 74.24 111.165 -179.991 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 5.8 t80 . . . . . 0 C--N 1.328 -0.355 0 CA-C-N 116.163 -0.471 . . . . 74.14 110.912 -179.861 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 224' ' ' PHE . . . . . 0.551 ' HE1' HG21 ' A' ' 193' ' ' THR . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.988 0.423 . . . . 65.01 110.895 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -143.76 161.0 39.73 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.166 -0.47 . . . . 64.24 110.907 179.941 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 226' ' ' LEU . . . . . 0.768 HD11 ' O ' ' A' ' 115' ' ' MET . 36.3 mt -64.38 147.99 51.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.272 -0.422 . . . . 53.44 110.849 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 227' ' ' SER . . . . . 0.463 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 0.9 OUTLIER -87.73 150.86 23.34 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.106 -0.497 . . . . 74.21 110.832 -179.924 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 -65.08 -66.8 0.5 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.18 -0.464 . . . . 74.54 110.922 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -55.37 -26.02 38.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.208 -0.451 . . . . 72.22 110.902 179.932 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -70.37 -49.04 53.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.156 -0.474 . . . . 74.23 110.868 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 231' ' ' ILE . . . . . 0.679 HD11 ' HB3' ' A' ' 226' ' ' LEU . 9.4 mt -69.4 -44.18 80.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.263 -0.426 . . . . 73.41 111.12 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.8 -31.98 65.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.142 -0.481 . . . . 65.42 110.932 179.86 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -70.13 -46.05 52.91 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.72 -0.753 . . . . 63.43 112.48 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 234' ' ' ILE . . . . . 0.438 HD12 ' SD ' ' A' ' 202' ' ' MET . 15.1 tt -73.18 -32.94 40.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.784 0.326 . . . . 71.54 111.114 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -66.33 -24.35 66.51 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.147 -0.479 . . . . 70.33 110.954 179.904 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 236' ' ' LYS . . . . . 0.46 ' HD3' ' N ' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.04 -28.97 61.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.172 -0.467 . . . . 51.21 110.829 -179.983 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 237' ' ' LEU . . . . . 0.738 HD22 ' CD ' ' A' ' 83' ' ' LYS . 5.7 tt -97.09 -23.61 16.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.251 -0.431 . . . . 75.41 110.925 179.952 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 238' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -92.45 -35.53 13.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.17 -0.468 . . . . 51.24 110.927 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.264 0 C-N-CA 120.724 -0.75 . . . . 32.22 112.451 179.977 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' -2' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.107 0 CA-C-O 121.572 0.701 . . . . 73.02 110.964 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -1' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 167.73 23.61 Favored 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 122.704 2.269 . . . . 71.15 112.327 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -174.88 73.6 0.3 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.67 0.747 . . . . 62.13 110.936 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 -171.34 0.46 Allowed 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.67 2.247 . . . . 64.14 112.316 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -153.13 77.0 1.14 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.179 -0.464 . . . . 60.51 110.935 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -95.3 -24.37 16.79 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.147 -0.478 . . . . 74.01 110.864 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.45 -33.96 66.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 71.4 111.143 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -55.87 -32.63 59.29 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.709 -0.758 . . . . 60.51 112.501 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -108.84 21.58 27.37 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.764 -0.731 . . . . 54.22 112.496 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.33 164.28 25.68 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.774 0.321 . . . . 72.23 110.855 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 47.9 t -87.03 168.73 13.05 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.221 -0.445 . . . . 73.24 110.857 -179.8 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.41 -31.94 71.87 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.136 -0.484 . . . . 50.12 110.848 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.38 -42.84 98.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.167 -0.469 . . . . 72.33 110.973 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.8 -40.73 95.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.146 -0.479 . . . . 72.14 110.939 179.887 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 21.1 t-105 -73.06 -35.42 66.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.187 -0.46 . . . . 71.22 110.898 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 49.7 tt0 -73.3 -35.46 66.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.267 -0.424 . . . . 72.51 110.852 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 13.3 mt-30 -62.92 -36.83 84.67 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.206 -0.452 . . . . 61.24 110.903 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.774 ' HB1' ' HE3' ' A' ' 62' ' ' MET . . . -57.1 -35.16 69.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.202 -0.454 . . . . 54.34 111.117 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.567 ' OE1' HD12 ' A' ' 35' ' ' LEU . 2.0 tt0 -64.78 -42.91 94.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.149 -0.478 . . . . 73.12 110.912 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -76.99 -31.48 56.53 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.19 -0.459 . . . . 72.4 110.87 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -60.33 -44.08 95.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.159 -0.473 . . . . 75.11 110.907 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.654 HD13 ' O ' ' A' ' 19' ' ' LEU . 3.0 tm? -71.43 -22.27 61.87 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.138 -0.483 . . . . 72.51 110.862 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.452 ' HE2' ' HA ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -72.3 -43.75 63.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.2 -0.455 . . . . 74.41 110.919 179.816 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.452 ' HA ' ' HE2' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -70.25 -27.84 64.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.445 . . . . 74.05 110.853 179.999 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -74.09 -5.72 43.33 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.21 -0.45 . . . . 74.31 110.852 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -120.75 -79.11 0.6 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.163 -0.471 . . . . 72.55 110.943 -179.907 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.699 ' HG ' HG23 ' A' ' 72' ' ' VAL . 18.7 mt -159.28 -176.81 6.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.133 -0.485 . . . . 75.43 110.882 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -94.48 89.65 5.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.173 -0.467 . . . . 71.41 110.92 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 56.8 m-20 -125.06 96.07 4.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.147 -0.479 . . . . 74.25 110.912 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.6 p -85.08 -6.44 59.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.213 -0.449 . . . . 62.15 110.858 -179.746 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -82.51 -21.65 35.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.144 -0.48 . . . . 74.51 110.88 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.678 HG21 ' HE2' ' A' ' 38' ' ' LYS . 4.9 m -76.9 -4.8 45.66 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.156 -0.475 . . . . 70.44 111.115 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 58.5 mttt -58.06 100.33 0.06 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.179 -0.464 . . . . 73.33 110.883 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -168.45 160.65 11.3 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.19 -0.459 . . . . 64.43 110.862 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.11 -39.69 60.41 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.147 -0.479 . . . . 70.21 111.121 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 -72.72 -40.27 66.28 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.191 -0.459 . . . . 35.31 110.858 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 59.7 m -59.53 -21.35 60.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 74.02 110.89 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.567 HD12 ' OE1' ' A' ' 16' ' ' GLN . 7.3 tt -63.74 -44.37 93.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.148 -0.478 . . . . 72.52 110.913 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.93 -51.12 65.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.136 -0.484 . . . . 73.13 110.857 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.31 -50.48 69.9 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.177 -0.465 . . . . 63.32 111.097 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.678 ' HE2' HG21 ' A' ' 29' ' ' THR . 24.4 mmmt -59.95 -49.51 77.39 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.226 -0.443 . . . . 72.32 110.896 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.905 HD11 HD22 ' A' ' 54' ' ' LEU . 0.1 OUTLIER -56.67 -36.99 70.21 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.266 -0.425 . . . . 72.11 110.894 179.917 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.5 ttmt -58.99 -45.5 90.48 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.451 . . . . 62.43 110.856 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.462 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 2.9 pt-20 -60.58 -32.84 71.92 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.247 -0.433 . . . . 75.11 110.827 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 7.2 ttt -68.47 -34.0 75.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.171 -0.468 . . . . 63.43 110.876 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.46 ' HG3' ' HA ' ' A' ' 51' ' ' THR . 2.3 mm100 -60.65 -39.98 90.33 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.215 -0.448 . . . . 74.45 110.916 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.2 mmpt? -70.58 -33.13 70.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 71.43 110.9 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 38.4 t80 -70.77 -37.33 73.36 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.232 -0.44 . . . . 73.32 110.903 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.727 ' HB3' HD23 ' A' ' 48' ' ' LEU . 2.7 m-85 -81.91 -35.63 28.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.108 -0.496 . . . . 70.43 110.869 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.447 ' HA2' ' HB3' ' A' ' 206' ' ' SER . . . 102.98 -10.2 55.41 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.742 -0.742 . . . . 64.34 112.51 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.727 HD23 ' HB3' ' A' ' 46' ' ' PHE . 0.7 OUTLIER -61.84 139.76 95.55 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.644 0.735 . . . . 64.11 110.898 -179.926 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.77 -53.23 0.28 Allowed 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.68 2.253 . . . . 74.5 112.318 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.649 HD12 HG23 ' A' ' 58' ' ' VAL . 0.9 OUTLIER -50.64 108.27 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.209 -0.451 . . . . 71.22 111.129 179.94 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.46 ' HA ' ' HG3' ' A' ' 43' ' ' GLN . 1.2 p -96.81 155.56 16.72 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.199 -0.455 . . . . 73.25 111.138 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 57.68 20.63 40.13 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.736 -0.745 . . . . 64.24 112.49 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.423 ' O ' HG11 ' A' ' 58' ' ' VAL . 2.0 mtt -99.81 158.91 15.46 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.759 0.314 . . . . 75.23 110.917 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.905 HD22 HD11 ' A' ' 39' ' ' LEU . 23.4 tp -174.63 78.54 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.287 -0.415 . . . . 73.4 110.928 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 178.8 -31.22 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.242 -0.435 . . . . 44.35 110.905 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 8.5 m -91.14 -99.81 0.11 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.159 -0.473 . . . . 75.25 110.867 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 42.6 ttt85 -84.96 -29.36 25.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.11 -0.496 . . . . 61.22 110.857 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.649 HG23 HD12 ' A' ' 50' ' ' ILE . 93.1 t -64.23 -41.61 92.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.208 -0.451 . . . . 70.12 111.117 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.606 HD12 ' CD1' ' A' ' 54' ' ' LEU . 0.1 OUTLIER -75.09 -31.72 25.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.192 -0.458 . . . . 74.43 111.11 179.938 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -63.58 -44.39 94.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.186 -0.461 . . . . 73.45 110.863 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.657 HD12 ' CE2' ' A' ' 46' ' ' PHE . 24.3 pt -67.32 -30.1 47.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 74.52 111.132 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.774 ' HE3' ' HB1' ' A' ' 15' ' ' ALA . 1.5 mmm -66.03 -36.22 82.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.159 -0.473 . . . . 74.01 110.931 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -87.74 -22.74 24.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 42.22 110.916 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 34.7 mttp -80.4 145.11 58.8 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.561 0.696 . . . . 65.34 110.888 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.81 161.08 47.31 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.689 2.259 . . . . 72.11 112.358 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.408 ' HG3' ' HA ' ' A' ' 214' ' ' PRO . 29.0 ttp180 -161.65 -82.5 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.195 -0.457 . . . . 71.51 110.903 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -145.36 156.45 43.79 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.175 -0.466 . . . . 55.3 110.878 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.652 ' HA2' HG23 ' A' ' 155' ' ' THR . . . -96.79 14.23 64.28 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.721 -0.752 . . . . 64.23 112.452 -179.862 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.696 HG12 ' HD2' ' A' ' 70' ' ' PRO . 0.0 OUTLIER -111.22 142.09 25.68 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.636 0.731 . . . . 74.23 111.098 179.996 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.696 ' HD2' HG12 ' A' ' 69' ' ' VAL . 53.7 Cg_endo -69.82 178.21 4.84 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.65 2.234 . . . . 63.44 112.367 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -107.97 -2.9 19.31 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.25 -0.432 . . . . 74.45 110.841 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.699 HG23 ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -141.83 129.74 21.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.224 -0.443 . . . . 53.43 111.166 179.989 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.553 ' HB1' ' HE1' ' A' ' 75' ' ' TYR . . . -131.08 170.43 14.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.188 -0.46 . . . . 73.13 111.142 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -179.74 96.32 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.222 -0.445 . . . . 73.31 110.894 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.553 ' HE1' ' HB1' ' A' ' 73' ' ' ALA . 6.4 p90 -150.37 84.99 1.38 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.145 -0.479 . . . . 70.41 110.943 -179.864 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 57.26 179.2 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.101 -0.5 . . . . 74.2 110.841 -179.841 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.9 mp -136.66 62.2 1.61 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.127 -0.488 . . . . 70.34 110.903 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' PHE . . . . . 0.476 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 1.7 m-85 -69.13 -60.75 3.93 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.669 0.747 . . . . 71.24 110.885 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.476 ' HD2' ' N ' ' A' ' 78' ' ' PHE . 53.6 Cg_endo -69.78 132.69 23.84 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.643 2.229 . . . . 73.34 112.362 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -66.49 129.2 39.03 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.185 -0.461 . . . . 74.43 110.915 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 62.88 159.63 0.12 Allowed Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.665 0.745 . . . . 70.4 110.828 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.81 -49.7 0.53 Allowed 'Trans proline' 0 C--O 1.232 0.182 0 C-N-CA 122.666 2.244 . . . . 71.11 112.309 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.703 ' CE ' HD13 ' A' ' 237' ' ' LEU . 8.5 mttp -83.31 168.43 16.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.252 -0.431 . . . . 64.45 110.913 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' TRP . . . . . 0.508 ' CD1' ' HA ' ' A' ' 200' ' ' LEU . 35.4 m95 -53.55 131.78 39.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.248 -0.433 . . . . 73.31 110.957 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.23 1.03 13.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.272 -0.422 . . . . 65.3 111.154 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.2 m -73.39 178.28 4.68 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.237 -0.438 . . . . 70.34 110.843 -179.826 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.81 -10.22 22.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.135 -0.484 . . . . 71.12 110.882 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -156.18 142.85 10.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.221 -0.445 . . . . 74.14 111.073 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 76.8 t -116.65 130.33 71.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.15 -0.477 . . . . 72.25 111.081 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.498 HG23 ' HB3' ' A' ' 125' ' ' ARG . 0.0 OUTLIER -118.45 144.57 45.89 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.115 -0.493 . . . . 71.01 111.124 -179.967 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 4.6 p90 -137.62 146.38 43.87 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.202 -0.454 . . . . 70.51 110.937 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 6.1 ttt180 -149.4 131.68 15.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.113 -0.494 . . . . 71.25 110.833 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.484 ' H ' HD12 ' A' ' 93' ' ' ILE . 4.8 mp -75.18 132.52 33.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.191 -0.459 . . . . 72.4 111.13 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 21.6 t -86.25 -40.25 14.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.163 -0.471 . . . . 60.2 111.112 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 92.0 p -156.42 169.34 24.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.172 -0.467 . . . . 64.24 110.818 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 11.5 p90 -125.39 154.98 41.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.126 -0.488 . . . . 72.25 110.911 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.9 t -96.59 141.14 30.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.159 -0.473 . . . . 64.11 111.097 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 2.6 mmp_? -53.06 -18.22 1.97 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 72.14 110.827 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.94 -35.92 82.71 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.196 -0.456 . . . . 74.13 110.894 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.51 HD22 HG21 ' A' ' 104' ' ' THR . 1.0 OUTLIER -141.86 153.7 64.65 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.602 0.715 . . . . 72.52 110.89 -179.987 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 101' ' ' PRO . . . . . 0.564 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.6 Cg_endo -69.77 151.02 68.88 Favored 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.692 2.262 . . . . 73.11 112.356 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 11.8 t-160 -52.36 -27.6 16.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.229 -0.441 . . . . 74.11 110.833 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.564 HG22 ' HB2' ' A' ' 101' ' ' PRO . 0.0 OUTLIER -75.37 -40.5 42.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.232 -0.44 . . . . 74.02 111.141 179.991 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 104' ' ' THR . . . . . 0.651 ' O ' HD22 ' A' ' 108' ' ' LEU . 3.6 m -69.83 -38.42 76.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.138 -0.483 . . . . 52.11 111.184 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.797 ' O ' HG13 ' A' ' 109' ' ' VAL . 81.3 t -72.81 -45.55 56.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.173 -0.467 . . . . 71.51 111.134 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.674 ' O ' HG22 ' A' ' 109' ' ' VAL . 2.6 t0 -63.41 -42.6 98.77 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.183 -0.462 . . . . 63.44 110.829 179.929 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 11.2 ptm180 -70.11 -34.15 72.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.462 . . . . 75.02 110.87 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.651 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -62.08 -48.73 78.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.217 -0.447 . . . . 71.04 110.914 -179.969 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.797 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.5 m -55.4 -42.12 65.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.454 . . . . 72.31 111.114 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.469 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 48.0 t -70.22 -33.36 71.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.223 -0.444 . . . . 72.14 110.894 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.417 ' HB3' HD21 ' A' ' 189' ' ' LEU . 0.3 OUTLIER -61.84 -32.82 73.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.15 -0.477 . . . . 74.35 110.876 179.964 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -97.48 -40.31 8.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.198 -0.456 . . . . 74.32 111.059 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.843 HD12 HD12 ' A' ' 196' ' ' LEU . 0.3 OUTLIER -65.26 -33.58 76.33 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.243 -0.435 . . . . 72.0 110.88 -179.943 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 46.6 t30 -69.74 -40.55 76.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 72.34 110.9 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' MET . . . . . 0.72 ' HB3' HD23 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -58.86 -34.56 71.75 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.206 -0.452 . . . . 54.12 110.868 179.91 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 7.8 m95 -66.45 -41.33 89.25 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.211 -0.45 . . . . 75.23 110.915 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -72.72 -38.85 56.66 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.761 -0.733 . . . . 73.32 112.471 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.0 mmpt? -62.66 -16.3 56.28 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.758 0.313 . . . . 72.42 110.921 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.619 ' HB3' HG23 ' A' ' 231' ' ' ILE . 37.2 mm-40 -100.4 13.33 34.83 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.222 -0.444 . . . . 75.24 110.892 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.8 HD12 HD12 ' A' ' 122' ' ' LEU . 6.4 pt -148.09 152.62 40.22 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.601 0.715 . . . . 71.34 111.136 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.74 1.21 4.63 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.685 2.257 . . . . 72.21 112.325 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.8 HD12 HD12 ' A' ' 120' ' ' ILE . 4.3 mt -62.63 -156.61 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.228 -0.442 . . . . 73.22 110.936 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 44.0 t-80 -160.56 142.61 12.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.151 -0.477 . . . . 74.12 110.837 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 28.5 m-85 -121.59 148.52 44.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.182 -0.463 . . . . 75.54 110.849 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.498 ' HB3' HG23 ' A' ' 90' ' ' THR . 0.2 OUTLIER -126.97 141.69 51.73 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.136 -0.484 . . . . 75.14 110.93 -179.949 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 126' ' ' LYS . . . . . 0.57 ' HE3' HG13 ' A' ' 128' ' ' VAL . 0.1 OUTLIER -80.63 148.61 30.18 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.235 -0.439 . . . . 72.22 110.937 179.967 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 127' ' ' VAL . . . . . 0.898 HG11 ' HB2' ' A' ' 132' ' ' ALA . 25.6 m -103.14 126.31 57.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.278 -0.419 . . . . 50.13 111.087 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.602 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -144.34 -11.11 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.163 -0.471 . . . . 74.43 111.081 179.945 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 129' ' ' TRP . . . . . 0.602 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -157.44 109.17 2.35 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.193 -0.458 . . . . 71.25 110.949 179.981 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 109.77 -162.65 12.62 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.758 -0.734 . . . . 62.11 112.485 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 9.7 p -101.96 156.06 17.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.759 0.314 . . . . 63.25 111.13 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' ALA . . . . . 0.898 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -111.77 165.39 12.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.186 -0.461 . . . . 51.34 111.098 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -71.88 -55.13 8.07 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.22 -0.445 . . . . 75.41 110.825 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' ILE . . . . . 0.436 HD12 ' N ' ' A' ' 134' ' ' ILE . 5.0 mp -95.37 108.8 21.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.251 -0.432 . . . . 70.51 111.114 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 14.2 mmm -90.76 127.75 36.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.189 -0.459 . . . . 72.43 110.941 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.42 ' O ' HG23 ' A' ' 93' ' ' ILE . 0.8 OUTLIER -106.24 95.14 3.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.263 -0.426 . . . . 70.04 111.147 179.948 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -132.06 163.52 23.88 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.753 -0.737 . . . . 63.34 112.517 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 138' ' ' PHE . . . . . 0.487 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 49.9 m-85 -105.22 150.03 25.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.864 0.364 . . . . 74.01 110.885 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.566 ' HB1' ' CB ' ' A' ' 143' ' ' HIS . . . 174.45 166.89 0.24 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.107 -0.497 . . . . 71.21 111.122 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.403 ' HB3' ' HB3' ' A' ' 149' ' ' PHE . 29.4 mtm180 -104.41 173.2 6.4 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.211 -0.45 . . . . 62.21 110.865 -179.883 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -57.28 -15.91 17.82 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.758 -0.734 . . . . 74.24 112.464 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -96.51 13.3 28.49 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.756 0.312 . . . . 75.03 111.039 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 143' ' ' HIS . . . . . 0.566 ' CB ' ' HB1' ' A' ' 139' ' ' ALA . 4.1 p80 -75.81 -5.15 44.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.245 -0.434 . . . . 71.11 110.862 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 121.37 20.41 3.28 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.741 -0.742 . . . . 45.51 112.498 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -124.76 173.31 8.66 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.843 0.354 . . . . 72.14 110.864 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 20.5 m -75.42 170.51 15.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.196 -0.456 . . . . 51.25 110.846 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 64.89 132.57 0.03 OUTLIER Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.703 0.763 . . . . 73.4 110.928 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 152.01 69.11 Favored 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.708 2.272 . . . . 74.53 112.372 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 149' ' ' PHE . . . . . 0.443 ' C ' ' H ' ' A' ' 151' ' ' GLY . 21.3 p90 -53.01 -41.4 64.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.243 -0.435 . . . . 63.52 110.877 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 76.19 -25.13 0.21 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.171 -0.468 . . . . 63.11 110.902 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 151' ' ' GLY . . . . . 0.443 ' H ' ' C ' ' A' ' 149' ' ' PHE . . . 77.07 -151.35 38.68 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.74 -0.743 . . . . 71.41 112.481 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.75 142.15 47.18 Favored 'Trans proline' 0 C--N 1.341 0.137 0 C-N-CA 122.704 2.269 . . . . 75.11 112.333 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 153' ' ' GLY . . . . . 0.434 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 104.15 -137.19 13.43 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.725 -0.75 . . . . 70.32 112.418 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 154' ' ' ASN . . . . . 0.434 ' C ' ' O ' ' A' ' 153' ' ' GLY . 4.1 p30 -34.53 138.09 0.11 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.955 0.407 . . . . 73.25 110.886 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 155' ' ' THR . . . . . 0.652 HG23 ' HA2' ' A' ' 68' ' ' GLY . 1.5 m 73.29 112.23 0.06 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.166 -0.47 . . . . 44.41 111.171 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 156' ' ' LEU . . . . . 1.042 HD21 HG21 ' A' ' 186' ' ' ILE . 0.6 OUTLIER -94.92 -53.09 3.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.244 -0.434 . . . . 75.02 110.918 179.975 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 157' ' ' ALA . . . . . 0.548 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -163.85 148.58 10.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.201 -0.454 . . . . 71.42 111.107 179.773 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 16.1 p-80 -106.8 124.37 49.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 72.02 110.917 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -110.48 152.39 26.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.254 -0.43 . . . . 74.42 111.108 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -105.46 151.86 23.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.231 -0.44 . . . . 75.31 110.876 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 161' ' ' ALA . . . . . 0.702 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -82.79 164.06 48.56 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.581 0.705 . . . . 61.04 111.111 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 162' ' ' PRO . . . . . 0.702 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.9 Cg_endo -69.79 79.17 0.97 Allowed 'Trans proline' 0 C--N 1.34 0.127 0 C-N-CA 122.661 2.241 . . . . 74.44 112.347 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -137.98 124.71 3.03 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.73 -0.748 . . . . 61.41 112.497 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 63.31 -171.1 0.17 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.797 0.332 . . . . 73.1 111.135 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -86.0 -41.32 7.17 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.74 -0.743 . . . . 74.03 112.465 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 166' ' ' LEU . . . . . 0.43 ' C ' HD23 ' A' ' 166' ' ' LEU . 10.2 tt -71.32 -37.21 71.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.837 0.351 . . . . 65.12 110.913 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -79.11 161.24 47.12 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.766 -0.731 . . . . 43.43 112.488 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 91.29 23.08 30.24 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.765 -0.731 . . . . 74.31 112.54 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -94.42 167.03 11.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.848 0.356 . . . . 63.41 110.878 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.46 130.69 55.9 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.207 -0.451 . . . . 74.21 111.105 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 24.6 m170 -126.29 158.6 35.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.225 -0.443 . . . . 72.53 110.881 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -142.99 138.83 30.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.208 -0.451 . . . . 71.44 110.85 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 59.2 t0 -69.21 97.8 0.96 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.138 -0.483 . . . . 74.11 110.887 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.41 -17.04 10.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.228 -0.442 . . . . 72.25 110.844 -179.869 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -78.97 -16.12 57.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.464 . . . . 73.32 110.824 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -80.13 -174.96 4.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.229 -0.441 . . . . 63.2 110.911 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 24.7 mtm-85 -109.41 107.23 17.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 63.14 110.877 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 68.2 m95 -108.56 137.17 46.94 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.219 -0.446 . . . . 72.31 110.945 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 179' ' ' THR . . . . . 0.508 ' HA ' HD11 ' A' ' 100' ' ' LEU . 11.1 t -178.33 163.59 1.63 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.266 -0.425 . . . . 74.13 111.14 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -125.54 -72.59 0.66 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.18 -0.464 . . . . 45.33 110.871 179.89 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -60.25 -16.16 40.83 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.702 -0.761 . . . . 62.41 112.514 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 182' ' ' SER . . . . . 0.432 ' O ' ' C ' ' A' ' 183' ' ' SER . 0.3 OUTLIER -90.62 -24.38 20.54 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.909 0.385 . . . . 64.5 110.933 -179.781 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 183' ' ' SER . . . . . 0.432 ' C ' ' O ' ' A' ' 182' ' ' SER . 91.0 p 35.61 58.17 0.87 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.087 -0.506 . . . . 64.12 110.866 -179.847 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 9.1 tt -116.75 -33.5 4.79 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.09 -0.505 . . . . 74.2 110.91 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -119.38 -139.29 5.94 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.752 -0.737 . . . . 73.01 112.488 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 186' ' ' ILE . . . . . 1.042 HG21 HD21 ' A' ' 156' ' ' LEU . 8.5 mm -79.54 100.32 4.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.882 0.372 . . . . 73.22 111.162 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -48.96 119.13 2.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.136 -0.484 . . . . 71.31 110.888 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 188' ' ' PHE . . . . . 0.589 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.2 t80 -53.72 -34.36 58.6 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.172 -0.467 . . . . 75.45 110.891 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 189' ' ' LEU . . . . . 0.417 HD21 ' HB3' ' A' ' 111' ' ' LYS . 0.2 OUTLIER -67.16 -48.18 68.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.15 -0.477 . . . . 52.02 110.939 -179.991 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -70.12 -37.75 75.41 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.204 -0.453 . . . . 74.22 110.912 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 191' ' ' ALA . . . . . 0.58 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -72.63 -35.47 67.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.104 -0.498 . . . . 50.03 111.138 179.883 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 192' ' ' ALA . . . . . 0.715 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -60.79 -45.09 95.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.193 -0.458 . . . . 52.11 111.121 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 193' ' ' THR . . . . . 0.771 HG21 HG21 ' A' ' 211' ' ' VAL . 11.1 m -58.76 -44.99 90.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.17 -0.468 . . . . 72.43 111.12 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 6.8 t60 -73.04 -39.79 65.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.216 -0.447 . . . . 71.44 110.857 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -71.76 -48.13 48.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.178 -0.464 . . . . 71.01 111.102 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 196' ' ' LEU . . . . . 0.843 HD12 HD12 ' A' ' 113' ' ' LEU . 4.5 mm? -62.11 -37.01 83.46 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.243 -0.435 . . . . 74.51 110.917 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -60.74 -27.69 66.91 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.762 -0.733 . . . . 52.23 112.512 179.876 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 198' ' ' HIS . . . . . 0.406 ' CD2' HG21 ' A' ' 69' ' ' VAL . 6.5 m-70 -67.31 -35.07 78.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.752 0.31 . . . . 75.21 110.806 -179.948 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -68.73 -21.46 64.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.214 -0.448 . . . . 71.13 110.855 -179.774 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 200' ' ' LEU . . . . . 0.508 ' HA ' ' CD1' ' A' ' 84' ' ' TRP . 0.5 OUTLIER -88.53 2.11 53.57 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.12 -0.491 . . . . 64.13 110.91 -179.992 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 84.04 -7.67 70.03 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.731 -0.747 . . . . 50.41 112.474 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 202' ' ' MET . . . . . 0.622 ' SD ' HD12 ' A' ' 234' ' ' ILE . 98.7 mmm -53.92 167.47 0.27 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.781 0.324 . . . . 63.21 110.868 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -137.1 161.4 25.18 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.719 -0.753 . . . . 64.44 112.512 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 13.2 m-70 -57.43 143.85 38.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.824 0.345 . . . . 74.32 110.835 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -105.92 152.52 23.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 53.34 110.897 -179.835 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 206' ' ' SER . . . . . 0.447 ' HB3' ' HA2' ' A' ' 47' ' ' GLY . 1.1 m -88.07 -4.77 58.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.156 -0.474 . . . . 72.22 110.853 -179.802 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.55 138.98 83.52 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-O 121.603 0.716 . . . . 65.11 110.865 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 -7.92 22.29 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.684 2.256 . . . . 74.53 112.36 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 -125.72 28.91 6.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.234 -0.439 . . . . 63.52 110.915 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 210' ' ' ALA . . . . . 0.436 ' O ' ' HB2' ' A' ' 213' ' ' TYR . . . -87.11 145.61 26.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.151 -0.477 . . . . 62.23 111.09 179.879 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 211' ' ' VAL . . . . . 0.771 HG21 HG21 ' A' ' 193' ' ' THR . 0.3 OUTLIER -73.24 -26.05 22.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.459 . . . . 62.04 111.158 179.963 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 11.3 mmm -93.78 10.07 34.56 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.138 -0.483 . . . . 75.22 110.884 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 213' ' ' TYR . . . . . 0.443 ' CD1' ' HD2' ' A' ' 214' ' ' PRO . 0.5 OUTLIER -55.54 127.54 66.45 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.669 0.747 . . . . 73.43 110.918 -179.865 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 214' ' ' PRO . . . . . 0.443 ' HD2' ' CD1' ' A' ' 213' ' ' TYR . 54.0 Cg_endo -69.75 -18.47 37.03 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.634 2.222 . . . . 63.01 112.379 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 1.2 p -90.16 32.16 0.95 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.197 -0.456 . . . . 74.24 111.129 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 6.5 t80 -51.11 123.38 9.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.175 -0.466 . . . . 74.14 110.929 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . 149.26 90.88 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.793 -0.717 . . . . 74.22 112.535 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -179.12 -170.89 0.19 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.891 0.377 . . . . 64.22 110.857 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . -53.14 105.76 0.32 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.751 -0.738 . . . . 72.24 112.505 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 220' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -102.51 101.41 19.89 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.583 0.706 . . . . 41.43 110.923 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.77 159.99 51.35 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.702 2.268 . . . . 73.42 112.322 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -71.2 -18.56 62.47 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.215 -0.448 . . . . 74.21 110.909 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -96.39 10.01 39.47 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.171 -0.468 . . . . 60.33 110.91 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -51.75 127.28 20.26 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.143 -0.48 . . . . 65.01 110.871 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.98 -164.68 1.94 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.123 -0.49 . . . . 64.24 110.883 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 226' ' ' LEU . . . . . 0.72 HD23 ' HB3' ' A' ' 115' ' ' MET . 1.4 mm? -59.28 148.77 30.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.255 -0.43 . . . . 53.44 110.863 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 227' ' ' SER . . . . . 0.479 ' O ' HD12 ' A' ' 231' ' ' ILE . 10.5 t -86.93 163.43 17.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.184 -0.462 . . . . 74.21 110.841 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -64.88 -62.28 1.66 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.092 -0.504 . . . . 74.54 110.889 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -55.57 -28.47 55.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.179 -0.464 . . . . 72.22 110.833 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -69.22 -48.61 61.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.181 -0.463 . . . . 74.23 110.892 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 231' ' ' ILE . . . . . 0.619 HG23 ' HB3' ' A' ' 119' ' ' GLU . 7.9 mt -68.86 -41.73 82.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.165 -0.471 . . . . 73.41 111.123 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 33.7 pttt -65.65 -32.58 74.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.193 -0.458 . . . . 65.42 110.873 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -64.88 -47.22 85.34 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.773 -0.727 . . . . 63.43 112.466 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 234' ' ' ILE . . . . . 0.622 HD12 ' SD ' ' A' ' 202' ' ' MET . 8.5 tt -72.55 -30.32 33.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.792 0.329 . . . . 71.54 111.123 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -68.73 -23.81 64.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.181 -0.463 . . . . 70.33 110.896 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 236' ' ' LYS . . . . . 0.463 ' HD3' ' N ' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.31 -27.98 60.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.168 -0.469 . . . . 51.21 110.909 179.975 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 237' ' ' LEU . . . . . 0.703 HD13 ' CE ' ' A' ' 83' ' ' LYS . 9.9 tt -95.77 -31.25 13.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.199 -0.455 . . . . 75.41 110.901 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 238' ' ' TYR . . . . . . . . . . . . . 30.7 m-85 -92.02 -35.03 14.18 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.199 -0.455 . . . . 51.24 110.953 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -128.01 -120.24 2.29 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.781 -0.724 . . . . 32.22 112.506 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.43 152.13 20.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.771 0.32 . . . . 75.42 110.917 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 5.1 ptm180 -100.85 169.58 8.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.205 -0.452 . . . . 73.34 110.914 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 3.6 m -165.78 61.24 0.11 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.22 -0.445 . . . . 62.42 110.883 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 3.1 t30 61.61 100.35 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.152 -0.476 . . . . 72.13 110.884 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 32.4 p -133.1 -170.71 2.52 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.209 -0.45 . . . . 62.23 110.857 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -125.51 -173.84 2.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.124 -0.489 . . . . 70.43 110.886 -179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.87 178.64 7.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.191 -0.459 . . . . 72.11 110.91 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 116.269 -0.423 . . . . 74.13 110.902 179.861 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 302' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' -2' ' ' LEU . . . . . 0.577 HD23 ' HD2' ' A' ' -1' ' ' PRO . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.108 0 CA-C-O 121.613 0.72 . . . . 73.02 110.926 . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' -1' ' ' PRO . . . . . 0.577 ' HD2' HD23 ' A' ' -2' ' ' LEU . 53.5 Cg_endo -69.78 144.62 54.48 Favored 'Trans proline' 0 C--O 1.233 0.26 0 C-N-CA 122.675 2.25 . . . . 71.15 112.34 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 8.1 mt -145.3 73.7 14.26 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.601 0.715 . . . . 62.13 110.932 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.73 -172.0 0.53 Allowed 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.694 2.263 . . . . 64.14 112.369 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -150.24 72.29 1.1 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.228 -0.442 . . . . 60.51 110.898 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 26.7 mm-40 -95.07 -39.47 10.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.208 -0.451 . . . . 74.01 110.973 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.581 ' HB3' ' HB2' ' A' ' 55' ' ' ASN . . . -57.3 -33.96 68.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.159 -0.473 . . . . 71.4 111.162 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -55.88 -21.71 31.39 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.705 -0.76 . . . . 60.51 112.532 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -108.29 21.65 28.43 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.755 -0.736 . . . . 54.22 112.445 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -88.52 164.28 15.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.694 0.283 . . . . 72.23 110.895 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -82.92 168.69 16.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.231 -0.44 . . . . 73.24 110.866 -179.79 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -55.41 -31.99 62.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.149 -0.478 . . . . 50.12 110.904 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -63.11 -42.79 99.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.165 -0.471 . . . . 72.33 110.905 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -65.19 -40.59 94.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.238 -0.437 . . . . 72.14 110.892 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 16.2 t-105 -73.08 -33.92 65.92 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.204 -0.453 . . . . 71.22 110.898 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -67.16 -35.59 80.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.2 -0.454 . . . . 72.51 110.853 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.51 -37.61 88.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.183 -0.462 . . . . 61.24 110.908 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.1 -37.25 86.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.23 -0.441 . . . . 54.34 111.106 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -65.36 -42.85 92.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.219 -0.446 . . . . 73.12 110.85 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -76.55 -31.65 57.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.289 -0.414 . . . . 72.4 110.855 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -60.36 -43.65 96.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.213 -0.449 . . . . 75.11 110.934 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.617 HD22 ' CE2' ' A' ' 23' ' ' TYR . 0.8 OUTLIER -71.4 -21.24 62.02 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.15 -0.477 . . . . 72.51 110.93 179.89 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -71.55 -48.24 49.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.221 -0.445 . . . . 74.41 110.852 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.83 -28.53 69.92 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.258 -0.428 . . . . 74.05 110.883 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -62.59 -25.26 67.99 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.18 -0.464 . . . . 74.31 110.861 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.617 ' CE2' HD22 ' A' ' 19' ' ' LEU . 5.4 m-85 -120.66 50.11 1.37 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.125 -0.489 . . . . 72.55 110.937 -179.842 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.7 mt 56.97 -169.39 0.1 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.076 -0.511 . . . . 75.43 110.929 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -98.82 90.05 4.54 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.158 -0.474 . . . . 71.41 110.942 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -114.56 124.89 53.01 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.08 -0.509 . . . . 74.25 110.88 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 82.5 p -85.11 -6.32 59.31 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.252 -0.431 . . . . 62.15 110.854 -179.767 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -64.18 -14.37 54.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.155 -0.475 . . . . 74.51 110.858 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.553 HG23 ' CD ' ' A' ' 38' ' ' LYS . 0.2 OUTLIER -86.79 9.47 18.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.139 -0.482 . . . . 70.44 111.155 -179.844 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 7.4 tttm -51.45 170.09 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.165 -0.47 . . . . 73.33 110.911 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 67.06 139.87 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.261 -0.427 . . . . 64.43 110.907 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.424 ' O ' HD23 ' A' ' 35' ' ' LEU . . . -75.02 -32.14 61.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.13 -0.487 . . . . 70.21 111.028 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -59.41 -18.93 43.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.273 -0.421 . . . . 35.31 110.847 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 51.3 p -85.37 -21.61 28.78 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.162 -0.472 . . . . 74.02 110.91 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.503 ' O ' HD13 ' A' ' 39' ' ' LEU . 1.0 OUTLIER -57.84 -35.67 71.23 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.122 -0.49 . . . . 72.52 110.903 -179.991 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.1 -51.67 62.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.26 -0.427 . . . . 73.13 110.841 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.74 -44.13 86.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.47 . . . . 63.32 111.165 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.553 ' CD ' HG23 ' A' ' 29' ' ' THR . 0.0 OUTLIER -59.99 -38.3 82.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.208 -0.451 . . . . 72.32 110.844 179.994 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.503 HD13 ' O ' ' A' ' 35' ' ' LEU . 4.6 mp -67.45 -35.49 79.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.232 -0.44 . . . . 72.11 110.956 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.46 -45.93 87.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 62.43 110.899 179.863 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.54 ' HG3' ' N ' ' A' ' 42' ' ' MET . 0.0 OUTLIER -60.34 -31.92 70.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 75.11 110.943 179.902 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.553 ' SD ' HD11 ' A' ' 19' ' ' LEU . 1.4 ttt -68.27 -34.23 75.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.098 -0.501 . . . . 63.43 110.904 179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.434 HE22 HG21 ' A' ' 58' ' ' VAL . 1.5 mm-40 -62.22 -39.48 92.95 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.242 -0.435 . . . . 74.45 110.911 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.1 mmpt? -68.59 -27.33 65.96 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.209 -0.45 . . . . 71.43 110.908 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 34.4 t80 -69.79 -45.63 67.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.225 -0.443 . . . . 73.32 110.898 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.807 ' CZ ' HD13 ' A' ' 61' ' ' ILE . 8.5 m-85 -82.83 -34.52 26.86 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.096 -0.502 . . . . 70.43 110.907 -179.917 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 100.13 -3.05 56.77 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.719 -0.753 . . . . 64.34 112.486 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.553 HD23 ' CB ' ' A' ' 46' ' ' PHE . 0.5 OUTLIER -59.86 142.17 88.79 Favored Pre-proline 0 C--N 1.328 -0.356 0 CA-C-O 121.616 0.722 . . . . 64.11 110.856 -179.847 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.77 -52.55 0.32 Allowed 'Trans proline' 0 C--N 1.342 0.219 0 C-N-CA 122.706 2.271 . . . . 74.5 112.314 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.607 HD12 HG23 ' A' ' 58' ' ' VAL . 0.8 OUTLIER -52.67 108.24 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.262 -0.427 . . . . 71.22 111.128 179.953 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.405 ' HA ' ' HG3' ' A' ' 43' ' ' GLN . 1.5 t -108.58 158.5 17.51 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.214 -0.448 . . . . 73.25 111.153 179.93 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 58.61 18.06 36.41 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.722 -0.752 . . . . 64.24 112.545 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 1.9 mmm -118.95 161.14 20.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.799 0.333 . . . . 75.23 110.902 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.418 ' HA ' ' HB ' ' A' ' 58' ' ' VAL . 53.2 tp -157.64 83.87 0.89 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.273 -0.421 . . . . 73.4 110.961 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.581 ' HB2' ' HB3' ' A' ' 4' ' ' ALA . 0.4 OUTLIER -179.59 -31.9 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.173 -0.467 . . . . 44.35 110.859 179.951 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 56' ' ' SER . . . . . 0.419 ' HB3' HD13 ' A' ' 50' ' ' ILE . 28.9 t -80.12 -101.3 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.211 -0.449 . . . . 75.25 110.832 -179.808 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.43 ' HB3' HD11 ' A' ' 50' ' ' ILE . 0.1 OUTLIER -84.89 -28.15 26.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 61.22 110.924 -179.992 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.607 HG23 HD12 ' A' ' 50' ' ' ILE . 90.5 t -59.52 -43.35 90.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.188 -0.46 . . . . 70.12 111.066 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.412 HG12 HD12 ' A' ' 54' ' ' LEU . 3.9 mm -75.13 -31.36 24.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.199 -0.455 . . . . 74.43 111.105 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -59.56 -44.08 93.38 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 73.45 110.923 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.807 HD13 ' CZ ' ' A' ' 46' ' ' PHE . 1.6 pp -74.57 -29.25 23.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.18 -0.464 . . . . 74.52 111.157 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -57.95 -41.25 82.42 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.194 -0.457 . . . . 74.01 110.903 179.794 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -89.33 -24.47 21.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.26 -0.427 . . . . 42.22 110.888 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 10.2 mttm -85.22 120.05 72.99 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.594 0.711 . . . . 65.34 110.894 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.73 151.63 69.25 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.686 2.258 . . . . 72.11 112.36 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.76 -64.2 0.22 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.176 -0.465 . . . . 71.51 110.825 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 13.9 p -145.04 149.6 35.39 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.237 -0.438 . . . . 55.3 110.885 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.536 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -104.72 18.26 44.21 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.733 -0.746 . . . . 64.23 112.456 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.615 HG21 ' CD2' ' A' ' 198' ' ' HIS . 0.6 OUTLIER -96.16 135.54 22.6 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.576 0.703 . . . . 74.23 111.175 179.982 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.5 ' HD2' HG12 ' A' ' 69' ' ' VAL . 52.9 Cg_endo -69.87 143.06 49.1 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.677 2.251 . . . . 63.44 112.268 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -100.2 26.49 6.46 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.164 -0.471 . . . . 74.45 110.858 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -130.5 129.41 64.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.176 -0.466 . . . . 53.43 111.152 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -131.01 170.55 14.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.183 -0.462 . . . . 73.13 111.146 179.833 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -145.29 105.97 4.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.24 -0.436 . . . . 73.31 110.883 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 28.6 m-85 -51.74 129.32 25.98 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.195 -0.457 . . . . 70.41 110.871 -179.806 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -179.62 100.58 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.058 -0.519 . . . . 74.2 110.895 -179.87 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 55.95 21.9 5.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.127 -0.488 . . . . 70.34 110.932 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 32.0 p90 -49.78 153.39 2.15 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.65 0.738 . . . . 71.24 110.878 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.82 126.8 13.69 Favored 'Trans proline' 0 C--N 1.343 0.238 0 C-N-CA 122.636 2.224 . . . . 73.34 112.304 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -50.93 127.31 18.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.195 -0.457 . . . . 74.43 110.842 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' SER . . . . . 0.415 ' HA ' ' HD2' ' A' ' 82' ' ' PRO . 0.7 OUTLIER 63.06 104.42 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.674 0.749 . . . . 70.4 110.841 -179.904 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.473 ' HG2' ' H ' ' A' ' 83' ' ' LYS . 53.8 Cg_endo -69.69 -72.13 0.02 OUTLIER 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.694 2.263 . . . . 71.11 112.368 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.801 ' HD2' HD22 ' A' ' 237' ' ' LEU . 4.4 mttp -45.13 141.86 2.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.199 -0.455 . . . . 64.45 110.914 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' TRP . . . . . 0.67 ' CE3' HG21 ' A' ' 89' ' ' VAL . 40.5 m0 -47.05 109.87 0.24 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.223 -0.444 . . . . 73.31 110.907 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -114.09 -6.98 13.09 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.288 -0.414 . . . . 65.3 111.146 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -58.18 168.64 0.99 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.209 -0.45 . . . . 70.34 110.883 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 18.7 mttp -73.96 -30.55 62.59 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.095 -0.502 . . . . 71.12 110.942 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -159.84 144.93 6.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.215 -0.448 . . . . 74.14 111.17 179.841 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.67 HG21 ' CE3' ' A' ' 84' ' ' TRP . 13.0 t -126.2 140.96 47.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.194 -0.457 . . . . 72.25 111.082 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 76.8 p -122.38 166.52 14.58 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.172 -0.467 . . . . 71.01 111.17 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.407 ' HB3' ' HB ' ' A' ' 134' ' ' ILE . 3.9 p90 -151.42 146.29 25.85 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.261 -0.427 . . . . 70.51 110.915 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 17.2 ttt180 -146.33 137.42 24.4 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.139 -0.482 . . . . 71.25 110.952 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.424 ' N ' HD12 ' A' ' 93' ' ' ILE . 3.5 mp -75.0 135.44 27.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.182 -0.463 . . . . 72.4 111.144 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.449 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 21.8 t -89.25 -40.63 13.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.225 -0.443 . . . . 60.2 111.114 179.846 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 1.7 t -143.74 161.83 37.59 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.197 -0.456 . . . . 64.24 110.861 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 11.8 p90 -110.19 153.25 25.03 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.129 -0.487 . . . . 72.25 110.901 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.493 ' OG1' HG21 ' A' ' 105' ' ' VAL . 0.2 OUTLIER -82.61 140.94 32.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.139 -0.482 . . . . 64.11 111.112 -179.966 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 6.5 ppt_? -73.67 -7.66 52.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.276 -0.42 . . . . 72.14 110.863 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -96.57 -25.98 15.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.194 -0.457 . . . . 74.13 110.869 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.612 HD21 ' HA ' ' A' ' 179' ' ' THR . 0.6 OUTLIER -133.64 153.73 80.32 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.599 0.714 . . . . 72.52 110.914 -179.959 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 101' ' ' PRO . . . . . 0.606 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.9 Cg_endo -69.69 150.91 69.24 Favored 'Trans proline' 0 C--O 1.231 0.151 0 C-N-CA 122.723 2.282 . . . . 73.11 112.318 179.902 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 16.3 t-160 -53.35 -25.57 15.73 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.233 -0.44 . . . . 74.11 110.83 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.606 HG22 ' HB2' ' A' ' 101' ' ' PRO . 13.2 tt -76.58 -38.74 31.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.231 -0.441 . . . . 74.02 111.134 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' THR . . . . . 0.655 ' O ' HD22 ' A' ' 108' ' ' LEU . 3.1 m -69.21 -39.94 78.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.197 -0.456 . . . . 52.11 111.197 179.911 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.717 ' O ' HG13 ' A' ' 109' ' ' VAL . 91.6 t -72.7 -45.95 55.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 71.51 111.169 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.674 ' O ' HG22 ' A' ' 109' ' ' VAL . 4.8 t0 -63.41 -43.33 97.81 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.108 -0.496 . . . . 63.44 110.831 179.939 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -70.16 -33.63 72.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.139 -0.482 . . . . 75.02 110.825 -179.827 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.655 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -60.7 -48.72 80.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.216 -0.447 . . . . 71.04 110.937 -179.989 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.717 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.5 m -55.28 -41.58 62.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.263 -0.426 . . . . 72.31 111.132 179.836 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.461 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 42.9 t -70.13 -33.43 71.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 72.14 110.906 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.428 ' HB3' HD21 ' A' ' 189' ' ' LEU . 0.4 OUTLIER -61.93 -32.92 73.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.081 -0.509 . . . . 74.35 110.875 179.971 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.69 -40.91 8.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.239 -0.437 . . . . 74.32 111.13 179.842 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.76 HD12 HD12 ' A' ' 196' ' ' LEU . 0.4 OUTLIER -65.69 -34.12 77.46 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.199 -0.455 . . . . 72.0 110.971 179.944 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -69.36 -35.11 75.53 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.199 -0.455 . . . . 72.34 110.904 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' MET . . . . . 0.4 ' O ' HD11 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -67.07 -34.98 78.84 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.181 -0.463 . . . . 54.12 110.963 179.857 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 6.8 m95 -64.47 -49.18 72.41 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.216 -0.447 . . . . 75.23 110.92 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' GLY . . . . . 0.409 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -71.84 -29.86 66.7 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.703 -0.761 . . . . 73.32 112.479 -179.918 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.2 mtmt -61.36 -17.71 55.24 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.817 0.342 . . . . 72.42 110.923 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.797 ' HB3' HG23 ' A' ' 231' ' ' ILE . 18.7 mm-40 -97.96 13.26 31.4 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.124 -0.489 . . . . 75.24 110.901 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.903 HD12 HD12 ' A' ' 122' ' ' LEU . 3.3 pt -148.28 144.96 19.37 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.631 0.729 . . . . 71.34 111.096 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.69 28.17 0.18 Allowed 'Trans proline' 0 C--O 1.232 0.206 0 C-N-CA 122.72 2.28 . . . . 72.21 112.316 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.903 HD12 HD12 ' A' ' 120' ' ' ILE . 10.3 mt -76.83 -160.25 0.15 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.275 -0.42 . . . . 73.22 110.911 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 4.1 t-80 -153.49 120.95 5.88 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.165 -0.47 . . . . 74.12 110.831 179.859 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 9.3 m-30 -110.31 142.74 41.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.189 -0.46 . . . . 75.54 110.838 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -123.84 141.23 52.22 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.123 -0.49 . . . . 75.14 110.857 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.14 157.79 25.19 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.188 -0.46 . . . . 72.22 110.894 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 127' ' ' VAL . . . . . 0.857 HG11 ' HB2' ' A' ' 132' ' ' ALA . 25.2 m -103.15 126.32 57.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.208 -0.451 . . . . 50.13 111.149 179.816 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.599 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -145.82 -10.77 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.227 -0.442 . . . . 74.43 111.164 179.878 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 129' ' ' TRP . . . . . 0.599 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -156.57 109.18 2.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.177 -0.465 . . . . 71.25 110.888 179.991 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 105.28 -163.34 14.24 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.754 -0.736 . . . . 62.11 112.471 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -101.88 156.42 17.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.792 0.329 . . . . 63.25 111.101 -179.836 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 132' ' ' ALA . . . . . 0.857 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -111.41 165.27 12.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.16 -0.473 . . . . 51.34 111.127 179.892 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -76.74 -53.69 7.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.269 -0.423 . . . . 75.41 110.918 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 134' ' ' ILE . . . . . 0.644 HD12 ' N ' ' A' ' 134' ' ' ILE . 1.9 mp -89.92 107.76 18.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.21 -0.45 . . . . 70.51 111.085 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 135' ' ' MET . . . . . 0.449 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 22.0 mmm -95.79 130.94 42.57 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.15 -0.477 . . . . 72.43 110.878 179.814 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.533 ' CD1' HG22 ' A' ' 134' ' ' ILE . 0.3 OUTLIER -111.22 90.29 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.186 -0.461 . . . . 70.04 111.113 179.964 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 137' ' ' GLY . . . . . 0.415 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -130.02 167.46 21.72 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.769 -0.729 . . . . 63.34 112.522 179.899 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 138' ' ' PHE . . . . . 0.448 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 46.8 m-85 -105.49 150.88 24.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.9 0.381 . . . . 74.01 110.908 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.574 ' HB1' ' CB ' ' A' ' 143' ' ' HIS . . . 177.01 167.42 0.54 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.179 -0.464 . . . . 71.21 111.13 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 6.7 mtp180 -103.94 173.09 6.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.172 -0.467 . . . . 62.21 110.913 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -57.91 -15.55 20.89 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.73 -0.747 . . . . 74.24 112.506 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -98.74 13.32 32.68 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.831 0.348 . . . . 75.03 111.104 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 143' ' ' HIS . . . . . 0.574 ' CB ' ' HB1' ' A' ' 139' ' ' ALA . 6.2 p80 -71.48 -9.36 58.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.242 -0.435 . . . . 71.11 110.871 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 118.99 49.84 0.32 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.748 -0.739 . . . . 45.51 112.461 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -170.23 -176.78 2.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.767 0.318 . . . . 72.14 110.877 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -76.19 -179.74 5.21 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.259 -0.428 . . . . 51.25 110.903 -179.787 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 147' ' ' TYR . . . . . 0.43 ' HA ' ' HD2' ' A' ' 148' ' ' PRO . 0.2 OUTLIER 65.01 107.31 0.03 OUTLIER Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 121.656 0.741 . . . . 73.4 110.863 -179.922 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 148' ' ' PRO . . . . . 0.43 ' HD2' ' HA ' ' A' ' 147' ' ' TYR . 53.8 Cg_endo -69.76 151.9 69.19 Favored 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.689 2.259 . . . . 74.53 112.334 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 149' ' ' PHE . . . . . 0.419 ' O ' ' CG ' ' A' ' 150' ' ' ASP . 0.4 OUTLIER -53.43 -25.51 16.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.242 -0.435 . . . . 63.52 110.89 179.98 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 150' ' ' ASP . . . . . 0.419 ' CG ' ' O ' ' A' ' 149' ' ' PHE . 2.0 p30 45.38 24.44 0.16 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.151 -0.477 . . . . 63.11 110.821 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 42.62 -160.52 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.743 -0.741 . . . . 71.41 112.511 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 144.55 54.38 Favored 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.701 2.267 . . . . 75.11 112.312 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 153' ' ' GLY . . . . . 0.457 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 105.97 -133.87 11.82 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.673 -0.775 . . . . 70.32 112.471 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 154' ' ' ASN . . . . . 0.457 ' C ' ' O ' ' A' ' 153' ' ' GLY . 3.3 p30 -33.67 136.64 0.11 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.906 0.384 . . . . 73.25 110.883 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 155' ' ' THR . . . . . 0.497 HG23 ' HA2' ' A' ' 68' ' ' GLY . 0.3 OUTLIER 75.35 107.77 0.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.124 -0.489 . . . . 44.41 111.132 -179.997 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 156' ' ' LEU . . . . . 1.043 HD21 HG21 ' A' ' 186' ' ' ILE . 0.7 OUTLIER -91.86 -55.21 3.55 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.258 -0.428 . . . . 75.02 110.949 179.924 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 157' ' ' ALA . . . . . 0.562 ' HB1' ' O ' ' A' ' 171' ' ' HIS . . . -158.76 148.88 19.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.198 -0.456 . . . . 71.42 111.136 179.758 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 26.1 p-80 -110.41 122.59 48.07 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.262 -0.426 . . . . 72.02 110.88 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.486 ' H ' HG22 ' A' ' 69' ' ' VAL . . . -110.52 161.1 16.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.231 -0.441 . . . . 74.42 111.075 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 18.9 m-30 -112.3 134.72 53.68 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.254 -0.43 . . . . 75.31 110.897 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 161' ' ' ALA . . . . . 0.639 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -63.97 162.73 27.81 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.53 0.681 . . . . 61.04 111.091 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 162' ' ' PRO . . . . . 0.639 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 54.4 Cg_endo -69.73 71.59 1.49 Allowed 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.687 2.258 . . . . 74.44 112.366 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -136.08 110.1 0.78 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.776 -0.726 . . . . 61.41 112.537 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 67.1 165.93 0.22 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.89 0.376 . . . . 73.1 111.1 -179.839 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -54.72 -35.7 58.17 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.701 -0.762 . . . . 74.03 112.489 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.84 -19.53 63.46 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.896 0.379 . . . . 65.12 110.938 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -88.47 167.0 35.06 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.718 -0.753 . . . . 43.43 112.479 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 168' ' ' GLY . . . . . 0.427 ' O ' HG13 ' A' ' 134' ' ' ILE . . . 80.47 -1.95 79.91 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.81 -0.71 . . . . 74.31 112.482 -179.906 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -70.57 148.3 48.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.846 0.355 . . . . 63.41 110.835 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.3 130.16 56.04 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.215 -0.448 . . . . 74.21 111.047 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 171' ' ' HIS . . . . . 0.562 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 26.5 m170 -129.69 132.18 46.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.224 -0.444 . . . . 72.53 110.885 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -114.23 138.94 49.83 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.235 -0.439 . . . . 71.44 110.849 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 57.8 t0 -70.63 97.82 1.4 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.157 -0.474 . . . . 74.11 110.877 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.92 -16.69 7.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.222 -0.445 . . . . 72.25 110.933 -179.904 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -78.39 -16.16 57.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.168 -0.469 . . . . 73.32 110.851 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -84.94 -173.54 4.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.21 -0.45 . . . . 63.2 110.885 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 45.6 mtt85 -111.75 109.73 19.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.142 -0.481 . . . . 63.14 110.872 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 70.7 m95 -109.75 138.27 46.36 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.199 -0.455 . . . . 72.31 110.884 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 179' ' ' THR . . . . . 0.612 ' HA ' HD21 ' A' ' 100' ' ' LEU . 11.4 t -177.76 163.54 1.86 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.279 -0.419 . . . . 74.13 111.165 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -127.29 -72.04 0.65 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.204 -0.453 . . . . 45.33 110.826 179.916 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -58.67 -16.94 32.21 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.668 -0.777 . . . . 62.41 112.5 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 182' ' ' SER . . . . . 0.411 ' O ' ' C ' ' A' ' 183' ' ' SER . 1.2 m -92.56 -24.32 18.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.853 0.359 . . . . 64.5 110.846 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 183' ' ' SER . . . . . 0.411 ' C ' ' O ' ' A' ' 182' ' ' SER . 4.5 p 37.36 51.82 1.18 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.187 -0.46 . . . . 64.12 110.832 -179.802 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 41.8 tp -109.18 -33.44 6.87 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.112 -0.495 . . . . 74.2 110.947 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -118.74 -138.51 5.87 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.686 -0.769 . . . . 73.01 112.401 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 186' ' ' ILE . . . . . 1.043 HG21 HD21 ' A' ' 156' ' ' LEU . 8.2 mm -79.39 101.76 4.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.908 0.385 . . . . 73.22 111.165 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -49.38 119.18 3.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.162 -0.472 . . . . 71.31 110.895 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 188' ' ' PHE . . . . . 0.586 ' HD2' ' HB3' ' A' ' 108' ' ' LEU . 1.0 OUTLIER -53.99 -33.03 55.92 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.194 -0.457 . . . . 75.45 110.87 -179.99 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 189' ' ' LEU . . . . . 0.428 HD21 ' HB3' ' A' ' 111' ' ' LYS . 0.2 OUTLIER -67.24 -48.25 68.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.11 -0.495 . . . . 52.02 110.913 -179.945 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 23.0 t80 -70.4 -37.01 74.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.234 -0.439 . . . . 74.22 110.891 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 191' ' ' ALA . . . . . 0.473 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -72.65 -36.9 68.07 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.148 -0.478 . . . . 50.03 111.107 179.878 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 192' ' ' ALA . . . . . 0.704 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -57.9 -45.08 87.02 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.209 -0.45 . . . . 52.11 111.159 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 193' ' ' THR . . . . . 0.415 HG21 HG21 ' A' ' 211' ' ' VAL . 0.2 OUTLIER -59.58 -43.13 93.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.193 -0.458 . . . . 72.43 111.177 -179.975 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 4.9 t60 -72.59 -38.23 67.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.3 -0.409 . . . . 71.44 110.902 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -75.17 -47.36 28.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.235 -0.439 . . . . 71.01 111.108 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 196' ' ' LEU . . . . . 0.76 HD12 HD12 ' A' ' 113' ' ' LEU . 4.5 mm? -64.6 -43.72 92.87 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.27 -0.423 . . . . 74.51 110.908 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -57.4 -27.98 58.75 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.679 -0.772 . . . . 52.23 112.485 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 198' ' ' HIS . . . . . 0.615 ' CD2' HG21 ' A' ' 69' ' ' VAL . 4.8 m-70 -66.79 -43.88 82.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.764 0.316 . . . . 75.21 110.818 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.21 -21.83 64.2 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 71.13 110.837 -179.8 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 200' ' ' LEU . . . . . 0.433 ' O ' ' HA ' ' A' ' 83' ' ' LYS . 4.3 mt -84.68 -0.93 55.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.142 -0.481 . . . . 64.13 110.97 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 83.48 -3.97 83.23 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.721 -0.752 . . . . 50.41 112.501 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 202' ' ' MET . . . . . 0.59 ' SD ' HD12 ' A' ' 234' ' ' ILE . 99.6 mmm -51.79 172.79 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.855 0.359 . . . . 63.21 110.853 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -132.73 160.17 23.71 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.746 -0.74 . . . . 64.44 112.433 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 22.6 m-70 -61.53 161.73 9.21 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.786 0.327 . . . . 74.32 110.852 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -125.05 147.49 48.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.213 -0.448 . . . . 53.34 110.846 -179.786 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 8.3 p -87.92 -3.93 58.88 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.153 -0.476 . . . . 72.22 110.877 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -70.93 137.77 85.11 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.659 0.742 . . . . 65.11 110.823 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -69.85 -6.23 18.14 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.693 2.262 . . . . 74.53 112.277 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -130.9 29.26 4.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.279 -0.419 . . . . 63.52 110.842 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 210' ' ' ALA . . . . . 0.45 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.43 145.65 26.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.277 -0.42 . . . . 62.23 111.134 179.912 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 211' ' ' VAL . . . . . 0.415 HG21 HG21 ' A' ' 193' ' ' THR . 0.4 OUTLIER -66.91 -27.6 40.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.247 -0.433 . . . . 62.04 111.157 179.986 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 7.4 tpp -96.33 7.98 45.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.185 -0.461 . . . . 75.22 110.844 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 213' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -55.5 110.29 2.15 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.651 0.738 . . . . 73.43 110.962 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.69 -18.54 37.26 Favored 'Trans proline' 0 C--O 1.231 0.158 0 C-N-CA 122.747 2.298 . . . . 63.01 112.356 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 215' ' ' THR . . . . . 0.454 HG23 ' CG2' ' A' ' 61' ' ' ILE . 0.2 OUTLIER -84.24 55.71 3.45 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.224 -0.444 . . . . 74.24 111.152 -179.968 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 6.0 t80 -70.76 124.91 25.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 74.14 110.936 -179.895 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -91.7 -155.25 31.59 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.73 -0.748 . . . . 74.22 112.504 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -91.46 176.9 6.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.921 0.391 . . . . 64.22 110.867 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . 64.7 154.77 0.14 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.776 -0.726 . . . . 72.24 112.52 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 220' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -120.13 148.76 47.77 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-O 121.578 0.704 . . . . 41.43 110.884 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.85 168.66 21.03 Favored 'Trans proline' 0 C--N 1.341 0.147 0 C-N-CA 122.693 2.262 . . . . 73.42 112.302 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.93 -45.08 17.27 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.212 -0.449 . . . . 74.21 110.894 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -129.43 -40.13 1.45 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.201 -0.454 . . . . 60.33 110.9 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 224' ' ' PHE . . . . . 0.4 ' HZ ' ' HG1' ' A' ' 193' ' ' THR . 0.4 OUTLIER 64.03 137.48 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.199 -0.455 . . . . 65.01 110.927 -179.955 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -143.65 167.14 22.96 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.125 -0.489 . . . . 64.24 110.913 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 226' ' ' LEU . . . . . 0.699 HD13 ' HG3' ' A' ' 119' ' ' GLU . 0.4 OUTLIER -59.79 149.52 30.87 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.223 -0.444 . . . . 53.44 110.96 179.88 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 227' ' ' SER . . . . . 0.464 ' O ' HD12 ' A' ' 231' ' ' ILE . 5.9 t -86.88 158.6 19.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.236 -0.438 . . . . 74.21 110.85 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -65.4 -65.1 0.72 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.129 -0.487 . . . . 74.54 110.933 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -55.42 -26.34 41.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.196 -0.456 . . . . 72.22 110.822 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 230' ' ' ASP . . . . . 0.424 ' HB2' ' HB3' ' A' ' 227' ' ' SER . 33.1 t70 -69.34 -48.4 61.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.231 -0.44 . . . . 74.23 110.872 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 231' ' ' ILE . . . . . 0.797 HG23 ' HB3' ' A' ' 119' ' ' GLU . 8.7 mt -68.49 -42.94 84.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.193 -0.458 . . . . 73.41 111.118 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 7.4 pttt -63.86 -32.38 73.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.137 -0.483 . . . . 65.42 110.85 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -62.95 -49.76 69.51 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.708 -0.758 . . . . 63.43 112.446 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 234' ' ' ILE . . . . . 0.59 HD12 ' SD ' ' A' ' 202' ' ' MET . 9.1 tt -72.97 -31.99 37.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.831 0.348 . . . . 71.54 111.187 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 11.5 mt-30 -70.9 -23.64 62.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.142 -0.481 . . . . 70.33 110.882 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 236' ' ' LYS . . . . . 0.422 ' HE2' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -73.77 -28.46 61.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.175 -0.466 . . . . 51.21 110.865 179.963 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 237' ' ' LEU . . . . . 0.801 HD22 ' HD2' ' A' ' 83' ' ' LYS . 8.4 tt -97.98 -26.5 14.62 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.263 -0.426 . . . . 75.41 110.935 179.954 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 238' ' ' TYR . . . . . 0.446 ' CE1' HD11 ' A' ' 122' ' ' LEU . 15.1 m-85 -92.3 -35.28 13.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.465 . . . . 51.24 110.918 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -141.43 -119.61 1.56 Allowed Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.708 -0.758 . . . . 32.22 112.481 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 7.6 ttpp -86.07 148.71 25.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.711 0.291 . . . . 75.42 110.913 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 1.5 ptt180 -95.56 -169.55 1.98 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.278 -0.419 . . . . 73.34 110.924 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 2.9 p -178.85 38.01 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.264 -0.425 . . . . 62.42 110.852 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 1.9 t30 63.2 97.38 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.158 -0.474 . . . . 72.13 110.901 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 12.6 t -143.6 -179.85 6.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.143 -0.48 . . . . 62.23 110.832 -179.774 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 7.1 ptp85 -134.23 -170.04 2.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.16 -0.473 . . . . 70.43 110.919 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 5.2 ttpt -146.76 76.35 1.43 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 72.11 110.94 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 116.217 -0.447 . . . . 74.13 110.93 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 302' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' -2' ' ' LEU . . . . . . . . . . . . . 2.4 mp . . . . . 0 C--O 1.231 0.122 0 CA-C-O 121.584 0.707 . . . . 73.02 110.924 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' -1' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.71 155.68 65.46 Favored 'Trans proline' 0 C--O 1.233 0.262 0 C-N-CA 122.645 2.23 . . . . 71.15 112.381 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 0' ' ' LEU . . . . . 0.472 ' CB ' ' CD ' ' A' ' 1' ' ' PRO . 0.3 OUTLIER 179.8 -61.04 0.0 OUTLIER Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.612 0.72 . . . . 62.13 110.885 179.988 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.472 ' CD ' ' CB ' ' A' ' 0' ' ' LEU . 54.0 Cg_endo -69.72 171.15 14.94 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.754 2.303 . . . . 64.14 112.348 179.885 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -158.55 36.91 0.23 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.229 -0.441 . . . . 60.51 110.954 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -67.38 -23.36 65.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.192 -0.458 . . . . 74.01 110.861 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.36 -34.0 66.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.175 -0.466 . . . . 71.4 111.127 179.901 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -58.32 -21.55 48.14 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.701 -0.761 . . . . 60.51 112.474 -179.909 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -108.93 21.51 27.28 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.688 -0.767 . . . . 54.22 112.463 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 31.1 mtt -75.23 164.19 26.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.814 0.34 . . . . 72.23 110.879 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -83.88 168.6 15.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.216 -0.447 . . . . 73.24 110.863 -179.854 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -62.44 -32.03 72.83 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.082 -0.508 . . . . 50.12 110.944 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.96 -42.82 80.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.156 -0.475 . . . . 72.33 110.887 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.41 -39.18 78.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.167 -0.47 . . . . 72.14 110.886 179.939 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 22.1 t-105 -72.04 -40.38 68.43 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.23 -0.441 . . . . 71.22 110.912 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 71.6 tt0 -73.12 -36.95 66.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.264 -0.425 . . . . 72.51 110.932 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -65.0 -38.42 90.9 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 61.24 110.909 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.27 -39.05 74.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.13 -0.486 . . . . 54.34 111.116 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.421 HE22 HD22 ' A' ' 35' ' ' LEU . 3.3 mt-30 -69.74 -43.0 73.21 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.174 -0.466 . . . . 73.12 110.905 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -66.42 -31.36 72.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.2 -0.454 . . . . 72.4 110.846 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -61.22 -36.27 79.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.168 -0.469 . . . . 75.11 110.934 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.721 HD12 ' HG2' ' A' ' 38' ' ' LYS . 3.1 tm? -71.88 -21.02 61.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.06 -0.518 . . . . 72.51 110.868 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 4.2 ptmt -75.06 -28.84 60.52 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.235 -0.438 . . . . 74.41 110.841 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.7 ptp180 -86.35 -28.11 23.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.295 -0.412 . . . . 74.05 110.851 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -65.05 -18.15 65.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.18 -0.464 . . . . 74.31 110.895 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.601 ' HB3' HG21 ' A' ' 72' ' ' VAL . 7.6 m-85 -120.59 50.47 1.32 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.169 -0.469 . . . . 72.55 110.869 -179.788 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.706 ' HG ' HG23 ' A' ' 72' ' ' VAL . 4.0 mt 67.64 -169.05 0.19 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.144 -0.48 . . . . 75.43 110.929 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -100.71 92.06 4.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.178 -0.464 . . . . 71.41 110.897 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -117.09 94.82 4.72 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.154 -0.475 . . . . 74.25 110.809 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.5 p -85.0 -17.55 37.21 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.148 -0.478 . . . . 62.15 110.883 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -58.49 -23.33 57.61 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.139 -0.482 . . . . 74.51 110.866 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.0 m -88.76 9.44 24.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.169 -0.469 . . . . 70.44 111.153 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 4.5 ttmm -58.66 115.84 3.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.202 -0.454 . . . . 73.33 110.907 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -178.93 152.55 0.59 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.185 -0.461 . . . . 64.43 110.843 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.698 ' O ' HD23 ' A' ' 35' ' ' LEU . . . -75.15 -40.17 59.84 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.12 -0.491 . . . . 70.21 111.061 179.875 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -84.15 -18.66 35.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.243 -0.435 . . . . 35.31 110.898 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.4 m -59.99 -20.16 56.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.175 -0.466 . . . . 74.02 110.901 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.698 HD23 ' O ' ' A' ' 32' ' ' ALA . 2.1 pp -57.91 -38.79 76.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.114 -0.494 . . . . 72.52 110.964 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.87 -53.13 61.64 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.198 -0.455 . . . . 73.13 110.981 179.874 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -66.05 -36.89 84.44 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.091 -0.504 . . . . 63.32 111.062 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.721 ' HG2' HD12 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -65.34 -49.34 69.76 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.262 -0.426 . . . . 72.32 110.849 -179.969 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.981 HD11 HD22 ' A' ' 54' ' ' LEU . 4.4 mt -63.64 -35.37 80.31 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.23 -0.441 . . . . 72.11 110.925 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 12.7 tmtt? -59.89 -45.83 91.27 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.19 -0.459 . . . . 62.43 110.877 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 3.2 pt-20 -60.91 -32.77 72.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.191 -0.459 . . . . 75.11 110.913 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 27.0 ttp -68.34 -34.1 75.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 63.43 110.954 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.455 ' CD ' HD11 ' A' ' 48' ' ' LEU . 1.8 mm-40 -59.79 -39.59 85.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 74.45 110.878 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.6 mmpt? -70.56 -30.61 67.38 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.242 -0.436 . . . . 71.43 110.815 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 14.5 t80 -70.4 -42.22 71.95 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.255 -0.43 . . . . 73.32 110.893 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.823 ' CZ ' HD13 ' A' ' 61' ' ' ILE . 7.9 m-85 -82.19 -35.19 28.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.137 -0.483 . . . . 70.43 110.881 -179.886 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.431 ' HA3' ' HB3' ' A' ' 206' ' ' SER . . . 102.45 -7.81 54.32 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.777 -0.725 . . . . 64.34 112.479 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.529 HD23 ' CB ' ' A' ' 46' ' ' PHE . 0.7 OUTLIER -60.07 138.34 91.13 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-O 121.649 0.737 . . . . 64.11 110.869 -179.941 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.82 -52.12 0.34 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.677 2.252 . . . . 74.5 112.329 179.89 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.507 HD12 HG23 ' A' ' 58' ' ' VAL . 0.8 OUTLIER -52.08 108.26 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.202 -0.454 . . . . 71.22 111.161 179.914 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.409 ' HA ' ' HG3' ' A' ' 43' ' ' GLN . 6.8 p -101.86 159.09 15.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.135 -0.484 . . . . 73.25 111.166 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 58.44 18.63 37.54 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.734 -0.746 . . . . 64.24 112.484 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 27.8 mmt -103.98 160.98 14.37 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.803 0.335 . . . . 75.23 110.899 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.981 HD22 HD11 ' A' ' 39' ' ' LEU . 25.8 tp -173.69 86.17 0.05 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.271 -0.422 . . . . 73.4 110.952 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.0 p30 174.72 -28.3 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.141 -0.481 . . . . 44.35 110.862 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 25.5 m -94.44 -100.19 0.15 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.244 -0.435 . . . . 75.25 110.844 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.573 ' O ' HG23 ' A' ' 61' ' ' ILE . 3.3 tpp85 -84.79 -29.06 25.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.122 -0.49 . . . . 61.22 110.887 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.507 HG23 HD12 ' A' ' 50' ' ' ILE . 61.5 t -65.72 -41.03 89.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.153 -0.476 . . . . 70.12 111.092 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.415 HD13 ' HA ' ' A' ' 59' ' ' ILE . 1.0 OUTLIER -75.16 -31.61 24.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.244 -0.435 . . . . 74.43 111.195 179.899 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -59.52 -44.23 93.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 73.45 110.86 179.86 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.823 HD13 ' CZ ' ' A' ' 46' ' ' PHE . 1.3 pp -62.92 -29.03 46.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.149 -0.478 . . . . 74.52 111.12 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.44 ' N ' HG13 ' A' ' 61' ' ' ILE . 3.6 mmt -69.01 -35.03 76.2 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.215 -0.448 . . . . 74.01 110.852 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -88.56 -26.31 22.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.207 -0.452 . . . . 42.22 110.874 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.3 136.27 38.0 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.556 0.693 . . . . 65.34 110.891 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' PRO . . . . . 0.474 ' HB2' HD22 ' A' ' 156' ' ' LEU . 53.9 Cg_endo -69.74 127.62 14.88 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.621 2.214 . . . . 72.11 112.401 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 5.5 ttm180 -115.02 -88.05 0.58 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.271 -0.422 . . . . 71.51 110.864 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -146.02 156.39 43.45 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.17 -0.468 . . . . 55.3 110.935 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.508 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -98.22 21.05 48.02 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.796 -0.716 . . . . 64.23 112.462 -179.822 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.568 HG21 ' CD2' ' A' ' 198' ' ' HIS . 0.2 OUTLIER -109.79 135.32 20.44 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.627 0.727 . . . . 74.23 111.193 -179.994 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.524 ' HD2' HG12 ' A' ' 69' ' ' VAL . 54.7 Cg_endo -69.78 156.24 63.8 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.715 2.277 . . . . 63.44 112.381 179.964 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -105.84 6.28 31.46 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.26 -0.427 . . . . 74.45 110.867 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.706 HG23 ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -129.22 129.72 67.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.197 -0.456 . . . . 53.43 111.053 -179.924 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -130.78 170.3 14.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.208 -0.451 . . . . 73.13 111.129 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -177.18 173.02 1.84 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.223 -0.444 . . . . 73.31 110.883 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 65.23 152.38 0.06 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.13 -0.486 . . . . 70.41 110.933 -179.792 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 66.82 134.77 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.154 -0.476 . . . . 74.2 110.862 -179.84 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -74.95 -6.47 49.43 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.199 -0.455 . . . . 70.34 110.939 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER 63.69 160.0 0.12 Allowed Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.699 0.761 . . . . 71.24 110.901 180.0 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.431 ' HG3' ' HA2' ' A' ' 163' ' ' GLY . 54.1 Cg_endo -69.69 179.43 3.66 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.681 2.254 . . . . 73.34 112.35 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.822 ' HB2' HG21 ' A' ' 85' ' ' THR . 1.2 m120 -52.02 105.97 0.13 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.21 -0.45 . . . . 74.43 110.899 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 63.73 158.25 0.12 Allowed Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.64 0.733 . . . . 70.4 110.888 -179.807 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.69 -35.06 13.57 Favored 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.627 2.218 . . . . 71.11 112.351 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.647 ' HD2' HD22 ' A' ' 237' ' ' LEU . 26.2 mttp -92.68 165.47 12.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.229 -0.442 . . . . 64.45 110.891 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' TRP . . . . . 0.431 ' CD1' ' HA ' ' A' ' 200' ' ' LEU . 54.5 m95 -48.66 127.7 14.0 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.191 -0.459 . . . . 73.31 110.981 179.889 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.822 HG21 ' HB2' ' A' ' 80' ' ' ASN . 15.1 t -115.23 -1.37 12.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.301 -0.409 . . . . 65.3 111.218 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 3.6 m -68.15 -175.94 0.66 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.18 -0.464 . . . . 70.34 110.829 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 2.8 mttt -92.8 -25.03 18.33 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.099 -0.501 . . . . 71.12 110.904 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -153.83 142.13 13.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.206 -0.452 . . . . 74.14 111.138 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 58.8 t -116.6 130.22 71.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 72.25 111.167 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.671 HG22 ' HB3' ' A' ' 125' ' ' ARG . 11.7 p -120.01 168.07 11.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.207 -0.452 . . . . 71.01 111.109 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 2.9 p90 -145.38 146.93 31.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.217 -0.447 . . . . 70.51 110.933 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.431 ' CB ' ' HB3' ' A' ' 132' ' ' ALA . 0.5 OUTLIER -146.21 131.67 18.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.104 -0.498 . . . . 71.25 110.914 179.962 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.452 HD13 ' HB ' ' A' ' 136' ' ' ILE . 18.6 mm -74.99 127.2 36.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.138 -0.483 . . . . 72.4 111.096 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.565 HG22 ' SD ' ' A' ' 135' ' ' MET . 6.5 t -86.38 -40.8 14.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.184 -0.462 . . . . 60.2 111.1 179.826 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 32.9 t -157.16 169.52 24.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.449 . . . . 64.24 110.852 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 11.9 p90 -127.45 155.09 44.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.143 -0.481 . . . . 72.25 110.973 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 3.9 t -95.03 141.26 28.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.116 -0.493 . . . . 64.11 111.16 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 3.6 ptm180 -52.62 -18.96 2.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.287 -0.415 . . . . 72.14 110.836 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.31 -37.75 88.07 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.252 -0.431 . . . . 74.13 110.778 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.757 HD22 HG21 ' A' ' 104' ' ' THR . 1.3 mt -138.65 152.94 71.84 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.613 0.72 . . . . 72.52 110.925 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' PRO . . . . . 0.579 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.6 Cg_endo -69.69 151.12 69.41 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.788 2.325 . . . . 73.11 112.354 179.817 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 13.1 t-160 -51.27 -26.28 7.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.253 -0.43 . . . . 74.11 110.875 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.579 HG22 ' HB2' ' A' ' 101' ' ' PRO . 12.2 tt -77.53 -38.06 25.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.175 -0.466 . . . . 74.02 111.084 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 104' ' ' THR . . . . . 0.757 HG21 HD22 ' A' ' 100' ' ' LEU . 3.0 m -69.01 -40.33 78.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.202 -0.454 . . . . 52.11 111.131 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.76 ' O ' HG13 ' A' ' 109' ' ' VAL . 93.5 t -72.16 -46.19 59.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.266 -0.424 . . . . 71.51 111.097 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.662 ' O ' HG22 ' A' ' 109' ' ' VAL . 45.6 t0 -59.35 -45.69 90.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.202 -0.453 . . . . 63.44 110.842 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -70.36 -33.53 71.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.186 -0.461 . . . . 75.02 110.815 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.622 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -60.3 -49.09 78.99 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.246 -0.434 . . . . 71.04 110.888 -179.958 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.76 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.5 m -55.62 -41.49 64.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.153 -0.476 . . . . 72.31 111.045 179.892 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.465 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 37.5 t -70.0 -33.76 72.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.183 -0.462 . . . . 72.14 110.819 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.429 ' CG ' HD21 ' A' ' 189' ' ' LEU . 0.3 OUTLIER -61.92 -33.3 73.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.152 -0.476 . . . . 74.35 110.864 179.954 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -95.87 -40.28 9.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.225 -0.443 . . . . 74.32 111.092 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.696 ' CD1' HD12 ' A' ' 196' ' ' LEU . 0.4 OUTLIER -65.24 -32.9 74.81 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.205 -0.452 . . . . 72.0 110.92 -179.954 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 38.9 t30 -64.66 -35.51 81.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 72.34 110.846 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' MET . . . . . 0.542 ' O ' HD11 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -67.49 -33.79 75.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.174 -0.466 . . . . 54.12 110.862 179.932 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 9.4 m95 -70.58 -52.47 21.36 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.186 -0.461 . . . . 75.23 110.904 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -60.24 -43.61 98.31 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.724 -0.751 . . . . 73.32 112.494 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.97 -19.06 60.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.714 0.292 . . . . 72.42 110.85 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.73 ' HG2' HD13 ' A' ' 226' ' ' LEU . 0.2 OUTLIER -96.29 13.4 27.72 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.235 -0.438 . . . . 75.24 110.886 179.952 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 1.043 HD12 HD12 ' A' ' 122' ' ' LEU . 8.6 pt -146.89 147.04 28.32 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.55 0.691 . . . . 71.34 111.2 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 5.72 1.59 Allowed 'Trans proline' 0 C--O 1.233 0.245 0 C-N-CA 122.655 2.236 . . . . 72.21 112.32 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 1.043 HD12 HD12 ' A' ' 120' ' ' ILE . 10.9 mt -61.12 -160.96 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.2 -0.454 . . . . 73.22 110.894 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 8.7 t-80 -150.67 123.18 8.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.228 -0.442 . . . . 74.12 110.803 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 11.1 m-30 -107.54 148.76 28.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.253 -0.43 . . . . 75.54 110.934 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.671 ' HB3' HG22 ' A' ' 90' ' ' THR . 0.0 OUTLIER -133.03 141.24 48.14 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.153 -0.476 . . . . 75.14 110.843 -179.884 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.8 139.71 35.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 72.22 110.841 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 127' ' ' VAL . . . . . 0.92 HG11 ' HB2' ' A' ' 132' ' ' ALA . 19.1 m -102.91 133.43 46.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.228 -0.442 . . . . 50.13 111.046 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.446 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -146.68 -23.59 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.157 -0.474 . . . . 74.43 111.064 179.936 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 129' ' ' TRP . . . . . 0.446 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -138.59 109.3 6.64 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.195 -0.457 . . . . 71.25 110.961 179.924 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 108.48 -159.37 14.27 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.727 -0.749 . . . . 62.11 112.496 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.75 155.4 18.15 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.734 0.302 . . . . 63.25 111.158 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 132' ' ' ALA . . . . . 0.92 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -112.87 165.33 12.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.225 -0.443 . . . . 51.34 111.104 179.851 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -65.37 -60.31 3.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.25 -0.432 . . . . 75.41 110.85 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 19.3 mt -90.7 129.42 41.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.161 -0.472 . . . . 70.51 111.124 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' MET . . . . . 0.565 ' SD ' HG22 ' A' ' 94' ' ' VAL . 0.0 OUTLIER -107.85 122.97 47.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.136 -0.483 . . . . 72.43 110.869 179.882 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.452 ' HB ' HD13 ' A' ' 93' ' ' ILE . 0.8 OUTLIER -105.64 95.73 4.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.239 -0.437 . . . . 70.04 111.132 179.944 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 137' ' ' GLY . . . . . 0.4 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -130.96 166.62 22.6 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.73 -0.747 . . . . 63.34 112.542 179.851 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 138' ' ' PHE . . . . . 0.499 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 60.3 m-85 -105.28 149.14 26.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.912 0.387 . . . . 74.01 110.848 -179.859 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.617 ' HB1' ' CB ' ' A' ' 143' ' ' HIS . . . 173.89 167.23 0.2 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.116 -0.493 . . . . 71.21 111.105 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 33.3 mtt180 -104.19 173.39 6.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.217 -0.447 . . . . 62.21 110.871 -179.898 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -57.46 -15.3 16.41 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.681 -0.771 . . . . 74.24 112.475 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -100.91 14.17 32.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.85 0.357 . . . . 75.03 111.09 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 143' ' ' HIS . . . . . 0.617 ' CB ' ' HB1' ' A' ' 139' ' ' ALA . 8.9 p80 -68.19 -33.35 74.28 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.249 -0.432 . . . . 71.11 110.881 179.926 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 147.28 47.13 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.765 -0.731 . . . . 45.51 112.491 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -158.82 149.57 20.04 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.763 0.316 . . . . 72.14 110.857 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 146' ' ' SER . . . . . 0.475 ' O ' ' CB ' ' A' ' 147' ' ' TYR . 49.0 p -63.73 99.12 0.21 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.224 -0.444 . . . . 51.25 110.888 -179.777 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 147' ' ' TYR . . . . . 0.475 ' CB ' ' O ' ' A' ' 146' ' ' SER . 0.2 OUTLIER 163.04 121.21 0.0 OUTLIER Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.704 0.764 . . . . 73.4 110.848 -179.874 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.74 138.47 37.95 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.705 2.27 . . . . 74.53 112.372 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 149' ' ' PHE . . . . . 0.44 ' C ' ' H ' ' A' ' 151' ' ' GLY . 7.6 p90 -53.84 -42.38 68.44 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.209 -0.451 . . . . 63.52 110.841 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 75.61 -21.93 0.29 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.184 -0.462 . . . . 63.11 110.927 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 151' ' ' GLY . . . . . 0.44 ' H ' ' C ' ' A' ' 149' ' ' PHE . . . 78.83 -159.49 45.89 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.678 -0.773 . . . . 71.41 112.515 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.67 142.41 48.26 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.711 2.274 . . . . 75.11 112.363 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 153' ' ' GLY . . . . . 0.437 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 104.34 -137.52 13.62 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.752 -0.737 . . . . 70.32 112.522 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 154' ' ' ASN . . . . . 0.437 ' C ' ' O ' ' A' ' 153' ' ' GLY . 3.4 p30 -34.86 141.32 0.06 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.944 0.402 . . . . 73.25 110.826 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 155' ' ' THR . . . . . 0.5 HG23 ' HA2' ' A' ' 68' ' ' GLY . 0.2 OUTLIER 75.22 90.07 0.08 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.15 -0.477 . . . . 44.41 111.16 -179.964 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 156' ' ' LEU . . . . . 0.737 HD21 ' CG2' ' A' ' 186' ' ' ILE . 0.0 OUTLIER -71.9 -59.35 2.79 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.162 -0.472 . . . . 75.02 110.914 179.953 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 157' ' ' ALA . . . . . 0.508 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -161.59 148.82 14.57 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.198 -0.455 . . . . 71.42 111.088 179.779 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 158' ' ' HIS . . . . . 0.403 ' O ' ' HB2' ' A' ' 171' ' ' HIS . 15.4 p-80 -103.47 124.38 48.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.194 -0.457 . . . . 72.02 110.862 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.466 ' H ' HG22 ' A' ' 69' ' ' VAL . . . -110.58 159.41 17.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.225 -0.443 . . . . 74.42 111.083 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 14.2 m-85 -112.58 152.24 29.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.217 -0.447 . . . . 75.31 110.88 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 161' ' ' ALA . . . . . 0.68 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -81.67 163.64 53.01 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.591 0.71 . . . . 61.04 111.113 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 162' ' ' PRO . . . . . 0.68 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.6 Cg_endo -69.81 79.28 0.97 Allowed 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.667 2.245 . . . . 74.44 112.354 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 163' ' ' GLY . . . . . 0.431 ' HA2' ' HG3' ' A' ' 79' ' ' PRO . . . -148.87 122.8 1.53 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.752 -0.737 . . . . 61.41 112.504 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 1.1 m 66.43 149.75 0.05 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.803 0.335 . . . . 73.1 111.138 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -52.76 -45.45 60.65 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.687 -0.768 . . . . 74.03 112.474 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 166' ' ' LEU . . . . . 0.457 ' C ' HD23 ' A' ' 166' ' ' LEU . 10.1 tt -64.25 -39.9 94.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.891 0.377 . . . . 65.12 110.993 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -78.79 170.49 54.77 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.788 -0.72 . . . . 43.43 112.439 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 80.46 22.86 61.62 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.765 -0.731 . . . . 74.31 112.457 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 85.5 m-20 -96.32 165.13 12.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.853 0.359 . . . . 63.41 110.886 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.44 130.9 55.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.196 -0.456 . . . . 74.21 111.08 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 171' ' ' HIS . . . . . 0.403 ' HB2' ' O ' ' A' ' 158' ' ' HIS . 25.0 m170 -125.05 158.74 33.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.224 -0.444 . . . . 72.53 110.861 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -140.87 137.73 33.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.252 -0.431 . . . . 71.44 110.884 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 173' ' ' ASP . . . . . 0.421 ' HB3' ' OE1' ' A' ' 176' ' ' GLU . 13.6 t0 -70.85 100.92 2.02 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.133 -0.485 . . . . 74.11 110.861 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.05 -11.45 39.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.173 -0.467 . . . . 72.25 110.903 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -78.79 -16.53 57.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.143 -0.48 . . . . 73.32 110.85 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 176' ' ' GLU . . . . . 0.437 ' CD ' HD13 ' A' ' 156' ' ' LEU . 1.4 mt-10 -90.53 -168.83 2.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.253 -0.431 . . . . 63.2 110.893 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 54.1 mtt85 -115.64 121.49 42.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.162 -0.472 . . . . 63.14 110.869 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 60.4 m95 -116.92 144.42 44.56 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.213 -0.449 . . . . 72.31 110.916 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 179' ' ' THR . . . . . 0.609 ' HA ' HD21 ' A' ' 100' ' ' LEU . 2.5 t -177.0 163.81 2.21 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.224 -0.444 . . . . 74.13 111.139 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -125.07 -70.0 0.77 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.194 -0.457 . . . . 45.33 110.845 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -67.74 -10.8 59.09 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.68 -0.772 . . . . 62.41 112.529 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 182' ' ' SER . . . . . 0.518 ' HB3' HG21 ' A' ' 179' ' ' THR . 0.3 OUTLIER -95.07 -24.54 16.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.914 0.388 . . . . 64.5 110.881 -179.723 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 183' ' ' SER . . . . . 0.464 ' C ' ' O ' ' A' ' 182' ' ' SER . 56.8 m 32.94 66.17 0.21 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.076 -0.511 . . . . 64.12 110.898 -179.79 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 6.4 tp -116.9 -33.61 4.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.162 -0.472 . . . . 74.2 110.885 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -128.91 -128.26 3.04 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.756 -0.735 . . . . 73.01 112.506 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 186' ' ' ILE . . . . . 0.737 ' CG2' HD21 ' A' ' 156' ' ' LEU . 4.6 mm -79.33 97.56 2.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.856 0.36 . . . . 73.22 111.178 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -54.75 121.17 7.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.177 -0.465 . . . . 71.31 110.91 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 188' ' ' PHE . . . . . 0.639 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.3 t80 -54.43 -33.16 58.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.145 -0.479 . . . . 75.45 110.867 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 189' ' ' LEU . . . . . 0.644 HD12 ' CD2' ' A' ' 224' ' ' PHE . 0.1 OUTLIER -67.15 -47.93 69.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.134 -0.484 . . . . 52.02 110.965 -179.986 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 85.7 t80 -70.14 -38.09 75.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.142 -0.481 . . . . 74.22 110.962 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 191' ' ' ALA . . . . . 0.439 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -72.68 -35.4 67.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.098 -0.501 . . . . 50.03 111.027 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 192' ' ' ALA . . . . . 0.672 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -56.8 -44.88 82.38 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.277 -0.42 . . . . 52.11 111.143 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 193' ' ' THR . . . . . 0.587 HG21 ' HE1' ' A' ' 224' ' ' PHE . 0.6 OUTLIER -58.87 -43.04 90.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 72.43 111.177 -179.917 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 11.7 t-160 -72.88 -38.02 67.13 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.166 -0.47 . . . . 71.44 110.861 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -75.5 -47.44 27.02 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.15 -0.477 . . . . 71.01 111.104 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 196' ' ' LEU . . . . . 0.696 HD12 ' CD1' ' A' ' 113' ' ' LEU . 4.6 mm? -63.19 -43.98 96.67 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.234 -0.439 . . . . 74.51 110.864 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -59.14 -28.7 64.43 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.714 -0.755 . . . . 52.23 112.425 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 198' ' ' HIS . . . . . 0.568 ' CD2' HG21 ' A' ' 69' ' ' VAL . 5.1 m-70 -65.69 -32.88 74.68 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.789 0.328 . . . . 75.21 110.817 -179.899 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.57 -21.17 60.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.24 -0.436 . . . . 71.13 110.849 -179.768 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 200' ' ' LEU . . . . . 0.431 ' HA ' ' CD1' ' A' ' 84' ' ' TRP . 0.6 OUTLIER -88.72 2.3 53.61 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.131 -0.486 . . . . 64.13 110.916 179.946 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 84.12 -9.02 64.78 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.718 -0.753 . . . . 50.41 112.446 179.89 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 202' ' ' MET . . . . . . . . . . . . . 37.6 tpp -51.51 138.94 21.2 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.806 0.336 . . . . 63.21 110.855 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -105.12 159.06 15.8 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.744 -0.741 . . . . 64.44 112.53 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 16.0 m-70 -55.52 163.38 1.29 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.813 0.34 . . . . 74.32 110.838 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -123.61 147.81 47.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.184 -0.462 . . . . 53.34 110.834 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 206' ' ' SER . . . . . 0.431 ' HB3' ' HA3' ' A' ' 47' ' ' GLY . 0.7 OUTLIER -88.14 -4.03 58.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.128 -0.487 . . . . 72.22 110.854 -179.81 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -70.99 138.58 85.06 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.626 0.727 . . . . 65.11 110.836 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 -8.96 24.91 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.626 2.217 . . . . 74.53 112.37 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -127.98 29.71 5.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.237 -0.438 . . . . 63.52 110.934 179.956 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 210' ' ' ALA . . . . . 0.457 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.37 145.86 26.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.201 -0.454 . . . . 62.23 111.059 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -67.73 -28.77 42.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.246 -0.434 . . . . 62.04 111.115 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.75 8.84 42.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.149 -0.478 . . . . 75.22 110.908 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 213' ' ' TYR . . . . . 0.411 ' HA ' ' HD2' ' A' ' 214' ' ' PRO . 1.8 t80 -55.73 115.02 8.42 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.703 0.763 . . . . 73.43 110.925 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 214' ' ' PRO . . . . . 0.411 ' HD2' ' HA ' ' A' ' 213' ' ' TYR . 54.3 Cg_endo -69.67 -17.79 37.78 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.711 2.274 . . . . 63.01 112.389 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 215' ' ' THR . . . . . 0.402 ' HB ' ' CE2' ' A' ' 213' ' ' TYR . 0.2 OUTLIER -83.77 55.6 3.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.215 -0.448 . . . . 74.24 111.139 -179.946 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -85.11 122.78 29.81 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.206 -0.452 . . . . 74.14 110.942 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -147.87 -59.31 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.703 -0.761 . . . . 74.22 112.47 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 24.7 p-10 -51.7 170.38 0.05 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.924 0.392 . . . . 64.22 110.871 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . -50.89 157.24 2.45 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.732 -0.747 . . . . 72.24 112.531 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 220' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -75.19 153.67 86.31 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.604 0.716 . . . . 41.43 110.88 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -69.83 135.78 31.17 Favored 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.661 2.241 . . . . 73.42 112.355 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 11.3 mp0 -62.57 -38.87 91.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.259 -0.428 . . . . 74.21 110.868 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 87.1 m-20 -121.74 -34.93 3.3 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.237 -0.438 . . . . 60.33 110.937 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 224' ' ' PHE . . . . . 0.644 ' CD2' HD12 ' A' ' 189' ' ' LEU . 0.0 OUTLIER 66.75 135.84 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.113 -0.494 . . . . 65.01 110.882 -179.988 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.75 154.67 43.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 64.24 110.91 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 226' ' ' LEU . . . . . 0.73 HD13 ' HG2' ' A' ' 119' ' ' GLU . 12.0 mt -69.98 148.66 48.62 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.268 -0.424 . . . . 53.44 110.931 179.901 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 227' ' ' SER . . . . . 0.457 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 0.0 OUTLIER -86.65 155.43 20.41 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.154 -0.476 . . . . 74.21 110.861 -179.886 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 42.6 mt-30 -67.45 -66.09 0.6 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.109 -0.496 . . . . 74.54 110.98 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 229' ' ' ASP . . . . . 0.41 ' O ' ' HG2' ' A' ' 232' ' ' LYS . 1.0 OUTLIER -55.74 -26.63 46.48 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.156 -0.474 . . . . 72.22 110.864 179.959 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -69.1 -50.66 46.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.141 -0.481 . . . . 74.23 110.881 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 231' ' ' ILE . . . . . 0.694 HD11 HD22 ' A' ' 226' ' ' LEU . 2.8 mm -70.43 -42.18 78.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.222 -0.445 . . . . 73.41 111.118 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 232' ' ' LYS . . . . . 0.41 ' HG2' ' O ' ' A' ' 229' ' ' ASP . 0.0 OUTLIER -56.47 -32.34 64.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.22 -0.445 . . . . 65.42 110.904 179.84 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -64.55 -50.01 61.53 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.753 -0.737 . . . . 63.43 112.437 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 5.5 tt -73.19 -30.81 32.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.731 0.301 . . . . 71.54 111.089 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -66.38 -24.16 66.45 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.256 -0.429 . . . . 70.33 110.923 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 236' ' ' LYS . . . . . 0.463 ' HE2' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.1 -20.61 60.21 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.239 -0.437 . . . . 51.21 110.904 179.918 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 237' ' ' LEU . . . . . 0.647 HD22 ' HD2' ' A' ' 83' ' ' LYS . 9.8 tt -97.21 -31.38 12.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.217 -0.447 . . . . 75.41 110.935 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 238' ' ' TYR . . . . . 0.456 ' CZ ' HD11 ' A' ' 122' ' ' LEU . 26.4 m-85 -92.16 -35.02 14.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 51.24 110.901 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -136.94 -119.64 1.86 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.69 -0.767 . . . . 32.22 112.47 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 3.5 tttm -96.8 156.78 16.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.722 0.296 . . . . 75.42 110.916 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 11.1 ptt180 -92.08 -172.58 3.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.245 -0.434 . . . . 73.34 110.838 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -139.2 -179.75 6.05 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.196 -0.456 . . . . 62.42 110.864 -179.852 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 16.4 m120 -122.85 99.88 6.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.136 -0.484 . . . . 72.13 110.874 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -179.78 162.72 1.08 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.189 -0.459 . . . . 62.23 110.807 -179.852 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -160.32 174.6 13.93 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.114 -0.494 . . . . 70.43 110.899 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -130.75 -55.24 1.07 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.156 -0.474 . . . . 72.11 110.905 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.24 -0.436 . . . . 74.13 110.872 179.883 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 302' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' -2' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.095 0 CA-C-O 121.599 0.714 . . . . 73.02 110.933 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' -1' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.74 178.43 4.56 Favored 'Trans proline' 0 C--O 1.232 0.211 0 C-N-CA 122.694 2.263 . . . . 71.15 112.336 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -91.89 159.17 38.6 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-O 121.637 0.732 . . . . 62.13 110.953 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.77 -48.37 0.73 Allowed 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.729 2.286 . . . . 64.14 112.367 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -179.1 38.8 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.229 -0.441 . . . . 60.51 110.933 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -58.75 -26.32 63.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 74.01 110.922 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -59.74 -33.96 72.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.123 -0.49 . . . . 71.4 111.151 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -58.24 -38.4 89.95 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.76 -0.733 . . . . 60.51 112.465 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -109.03 21.58 26.93 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.75 -0.738 . . . . 54.22 112.494 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 5.7 mtt -61.31 161.03 9.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.823 0.344 . . . . 72.23 110.894 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 53.3 m -101.43 168.69 9.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.259 -0.428 . . . . 73.24 110.883 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -54.39 -33.23 58.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.136 -0.484 . . . . 50.12 110.852 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -68.36 -42.88 78.55 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.185 -0.461 . . . . 72.33 110.927 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.8 tp-100 -69.69 -39.63 76.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.189 -0.459 . . . . 72.14 110.893 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.582 ' CH2' HD23 ' A' ' 54' ' ' LEU . 70.0 t-105 -70.55 -41.49 72.41 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.202 -0.454 . . . . 71.22 110.872 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -72.2 -35.16 68.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.314 -0.403 . . . . 72.51 110.886 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -71.34 -36.51 71.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.113 -0.494 . . . . 61.24 110.946 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.587 ' HB1' ' SD ' ' A' ' 62' ' ' MET . . . -65.82 -44.1 86.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.254 -0.43 . . . . 54.34 111.076 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.571 ' OE1' HD21 ' A' ' 35' ' ' LEU . 0.0 OUTLIER -73.79 -31.92 63.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.264 -0.425 . . . . 73.12 110.865 -179.92 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.506 ' N ' ' HG3' ' A' ' 16' ' ' GLN . 74.5 m-20 -77.72 -31.09 52.05 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.259 -0.428 . . . . 72.4 110.898 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -59.75 -36.32 76.4 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.175 -0.466 . . . . 75.11 110.902 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.449 HD22 ' HA ' ' A' ' 19' ' ' LEU . 0.2 OUTLIER -72.24 -20.99 61.45 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.19 -0.459 . . . . 72.51 110.911 179.998 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 4.2 ptmt -74.0 -27.86 61.17 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.177 -0.465 . . . . 74.41 110.877 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.0 ptp180 -86.34 -27.73 24.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.23 -0.441 . . . . 74.05 110.804 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -60.16 -21.18 61.34 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.219 -0.446 . . . . 74.31 110.859 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.512 ' HB3' HG21 ' A' ' 72' ' ' VAL . 12.5 m-85 -120.38 50.41 1.32 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.134 -0.484 . . . . 72.55 110.952 -179.83 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.532 ' HG ' HG23 ' A' ' 72' ' ' VAL . 3.8 mt 68.64 -168.03 0.18 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.11 -0.496 . . . . 75.43 110.916 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -92.49 89.9 6.95 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.15 -0.477 . . . . 71.41 110.926 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -113.94 116.28 29.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.167 -0.47 . . . . 74.25 110.822 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 99.9 p -85.19 -6.39 59.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.235 -0.438 . . . . 62.15 110.885 -179.818 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.9 -15.36 58.85 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.125 -0.489 . . . . 74.51 110.895 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -80.87 0.86 33.29 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.133 -0.485 . . . . 70.44 111.098 -179.835 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.7 mptt -58.51 170.12 0.8 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.235 -0.439 . . . . 73.33 110.922 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 25.6 t30 65.55 156.78 0.09 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.285 -0.416 . . . . 64.43 110.861 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.588 ' HA ' HD13 ' A' ' 35' ' ' LEU . . . -74.69 -23.95 58.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.172 -0.467 . . . . 70.21 111.057 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -65.56 -18.8 65.59 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.226 -0.443 . . . . 35.31 110.888 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 52.8 m -85.58 -33.6 21.66 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.209 -0.451 . . . . 74.02 110.81 -179.795 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.588 HD13 ' HA ' ' A' ' 32' ' ' ALA . 10.8 mp -57.56 -44.89 85.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.163 -0.471 . . . . 72.52 110.952 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -61.8 -51.47 68.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.166 -0.47 . . . . 73.13 110.913 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -61.48 -50.51 72.47 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.116 -0.493 . . . . 63.32 111.138 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.83 -38.28 81.57 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.152 -0.476 . . . . 72.32 110.92 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.654 HD21 HD22 ' A' ' 54' ' ' LEU . 1.6 mp -61.63 -39.45 91.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.161 -0.472 . . . . 72.11 110.852 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 37.9 mttp -66.22 -46.71 76.25 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.205 -0.452 . . . . 62.43 110.935 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -70.57 -33.04 70.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.188 -0.46 . . . . 75.11 110.903 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.725 ' CE ' HD11 ' A' ' 61' ' ' ILE . 0.0 OUTLIER -67.31 -47.5 70.38 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.164 -0.471 . . . . 63.43 110.884 179.951 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.947 ' HA ' HD12 ' A' ' 48' ' ' LEU . 31.4 mt-30 -59.0 -42.8 90.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.225 -0.443 . . . . 74.45 110.96 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.3 mmpt? -59.6 -27.76 66.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.223 -0.444 . . . . 71.43 110.874 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -70.56 -37.67 74.04 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.24 -0.436 . . . . 73.32 110.834 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.728 ' CD2' HD12 ' A' ' 61' ' ' ILE . 31.3 m-85 -83.94 9.52 12.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.171 -0.468 . . . . 70.43 110.879 -179.863 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.457 ' HA2' ' HB3' ' A' ' 206' ' ' SER . . . 76.55 11.81 84.89 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.782 -0.723 . . . . 64.34 112.474 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.947 HD12 ' HA ' ' A' ' 43' ' ' GLN . 6.1 mt -76.4 121.73 85.44 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.56 0.695 . . . . 64.11 110.952 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.83 -44.77 1.84 Allowed 'Trans proline' 0 C--O 1.231 0.16 0 C-N-CA 122.643 2.229 . . . . 74.5 112.35 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 13.1 pt -58.87 129.67 21.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.193 -0.458 . . . . 71.22 111.144 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 76.5 p -115.2 128.88 56.45 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.127 -0.488 . . . . 73.25 111.179 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 90.95 30.03 11.93 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.746 -0.74 . . . . 64.24 112.45 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.749 ' O ' HG21 ' A' ' 58' ' ' VAL . 2.6 mmt -130.98 133.91 46.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.873 0.368 . . . . 75.23 110.845 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.654 HD22 HD21 ' A' ' 39' ' ' LEU . 17.3 tp -154.13 95.94 1.89 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.114 -0.493 . . . . 73.4 110.946 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.402 ' HA ' HG13 ' A' ' 59' ' ' ILE . 0.4 OUTLIER 171.01 -26.48 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.198 -0.455 . . . . 44.35 110.93 179.937 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 18.6 m -89.38 -99.62 0.09 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.118 -0.492 . . . . 75.25 110.855 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.638 ' O ' HG23 ' A' ' 61' ' ' ILE . 12.2 tpt85 -84.53 -27.42 27.37 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.199 -0.455 . . . . 61.22 110.905 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.749 HG21 ' O ' ' A' ' 53' ' ' MET . 24.8 t -58.06 -44.31 86.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.143 -0.48 . . . . 70.12 111.119 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.402 HG13 ' HA ' ' A' ' 55' ' ' ASN . 9.9 mm -74.55 -30.89 26.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.147 -0.479 . . . . 74.43 111.219 179.885 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -59.2 -35.04 72.89 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.119 -0.491 . . . . 73.45 110.892 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.728 HD12 ' CD2' ' A' ' 46' ' ' PHE . 0.4 OUTLIER -76.12 -29.18 19.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.194 -0.457 . . . . 74.52 111.13 179.951 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.587 ' SD ' ' HB1' ' A' ' 15' ' ' ALA . 7.0 mtt -61.76 -39.48 91.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.192 -0.458 . . . . 74.01 110.872 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -81.51 -22.73 37.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.22 -0.445 . . . . 42.22 110.873 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.1 mtmt -85.22 126.45 67.31 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.565 0.698 . . . . 65.34 110.95 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.66 140.1 42.22 Favored 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.72 2.28 . . . . 72.11 112.368 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.521 ' O ' HD23 ' A' ' 156' ' ' LEU . 0.2 OUTLIER -134.87 -77.72 0.45 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.254 -0.43 . . . . 71.51 110.901 -179.983 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -145.26 148.81 33.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.469 . . . . 55.3 110.926 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.594 ' HA3' HG22 ' A' ' 155' ' ' THR . . . -106.46 28.31 13.94 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.678 -0.773 . . . . 64.23 112.52 -179.909 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.694 HG21 ' CD2' ' A' ' 198' ' ' HIS . 0.2 OUTLIER -106.12 134.26 19.84 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 121.622 0.725 . . . . 74.23 111.135 -179.97 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.467 ' HD2' HG12 ' A' ' 69' ' ' VAL . 54.2 Cg_endo -69.7 132.69 23.96 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.706 2.27 . . . . 63.44 112.326 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -93.29 22.16 5.42 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.245 -0.434 . . . . 74.45 110.887 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.532 HG23 ' HG ' ' A' ' 24' ' ' LEU . 3.1 m -136.85 129.9 45.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.154 -0.475 . . . . 53.43 111.124 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -130.87 170.29 14.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.168 -0.469 . . . . 73.13 111.064 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 178.48 94.3 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.184 -0.462 . . . . 73.31 110.881 -179.95 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -160.62 163.85 32.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.184 -0.462 . . . . 70.41 110.908 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -111.65 175.31 5.48 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.058 -0.519 . . . . 74.2 110.871 -179.872 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 9.7 mt 62.55 16.94 9.19 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.167 -0.47 . . . . 70.34 110.923 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 15.7 p90 -57.17 156.71 13.62 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.599 0.714 . . . . 71.24 110.884 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.7 171.85 13.64 Favored 'Trans proline' 0 C--N 1.341 0.145 0 C-N-CA 122.716 2.277 . . . . 73.34 112.32 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.69 ' HB2' HG21 ' A' ' 85' ' ' THR . 0.4 OUTLIER -54.44 100.73 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.205 -0.452 . . . . 74.43 110.851 179.925 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 63.05 158.77 0.12 Allowed Pre-proline 0 C--N 1.33 -0.266 0 CA-C-O 121.621 0.724 . . . . 70.4 110.903 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.74 -10.81 29.49 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.696 2.264 . . . . 71.11 112.334 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.844 ' HD2' HD22 ' A' ' 237' ' ' LEU . 9.4 mttt -106.56 171.0 7.59 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.189 -0.46 . . . . 64.45 110.954 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 61.0 m95 -56.53 131.15 47.85 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.239 -0.437 . . . . 73.31 110.933 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.69 HG21 ' HB2' ' A' ' 80' ' ' ASN . 4.8 t -115.19 -16.34 11.56 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.172 -0.467 . . . . 65.3 111.089 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 3.3 m -59.06 172.89 0.51 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.247 -0.433 . . . . 70.34 110.887 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 2.8 mptp? -85.04 -21.17 29.51 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.124 -0.489 . . . . 71.12 110.931 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -154.8 143.57 13.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.197 -0.456 . . . . 74.14 111.111 179.836 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 25.7 t -119.64 130.44 74.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.167 -0.47 . . . . 72.25 111.171 179.855 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.671 HG22 ' HB3' ' A' ' 125' ' ' ARG . 43.5 p -115.77 163.53 15.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.471 . . . . 71.01 111.1 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 4.7 p90 -145.96 146.22 30.95 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.207 -0.451 . . . . 70.51 110.923 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 3.7 ttt-85 -151.69 139.09 19.46 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.131 -0.486 . . . . 71.25 110.849 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.522 HD11 ' HA ' ' A' ' 106' ' ' ASP . 11.1 mm -74.84 131.28 35.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.162 -0.472 . . . . 72.4 111.141 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.677 HG22 ' SD ' ' A' ' 135' ' ' MET . 9.3 t -88.6 -40.74 13.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.461 . . . . 60.2 111.183 179.812 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -151.52 169.36 22.27 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.128 -0.487 . . . . 64.24 110.792 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 13.8 p90 -129.63 155.08 46.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.11 -0.496 . . . . 72.25 110.98 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 2.1 t -102.79 141.84 34.92 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.183 -0.462 . . . . 64.11 111.194 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.44 -18.72 1.78 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.27 -0.423 . . . . 72.14 110.866 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -65.16 -37.32 87.0 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.158 -0.474 . . . . 74.13 110.847 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.413 HD21 ' HA ' ' A' ' 179' ' ' THR . 1.3 mp -142.37 152.82 61.62 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.681 0.753 . . . . 72.52 110.858 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' PRO . . . . . 0.59 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.4 Cg_endo -69.76 150.97 68.92 Favored 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 122.689 2.259 . . . . 73.11 112.337 179.883 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 3.7 t-160 -52.7 -25.62 11.53 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.225 -0.443 . . . . 74.11 110.882 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.59 HG22 ' HB2' ' A' ' 101' ' ' PRO . 13.9 tt -77.36 -39.2 27.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.15 -0.477 . . . . 74.02 111.098 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' THR . . . . . 0.78 ' O ' HD22 ' A' ' 108' ' ' LEU . 3.6 m -69.13 -36.21 77.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.18 -0.463 . . . . 52.11 111.181 179.938 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.772 HG13 ' CZ ' ' A' ' 188' ' ' PHE . 60.2 t -71.93 -42.91 68.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.226 -0.443 . . . . 71.51 111.126 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.654 ' O ' HG22 ' A' ' 109' ' ' VAL . 0.0 OUTLIER -67.02 -37.19 83.69 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.171 -0.468 . . . . 63.44 110.845 179.92 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 107' ' ' ARG . . . . . 0.49 ' HG3' ' N ' ' A' ' 108' ' ' LEU . 0.0 OUTLIER -70.72 -33.27 70.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.172 -0.467 . . . . 75.02 110.891 -179.876 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.78 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -66.44 -47.77 72.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.21 -0.45 . . . . 71.04 110.916 -179.978 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.767 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.5 m -55.03 -42.99 67.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.146 -0.479 . . . . 72.31 111.091 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.493 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 30.2 t -70.62 -33.8 71.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.256 -0.429 . . . . 72.14 110.858 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.465 ' HB3' HD21 ' A' ' 189' ' ' LEU . 0.3 OUTLIER -62.02 -33.11 73.76 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.17 -0.468 . . . . 74.35 110.913 179.914 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.7 -40.14 9.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.188 -0.46 . . . . 74.32 111.048 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.695 ' CD1' HD12 ' A' ' 196' ' ' LEU . 0.4 OUTLIER -64.73 -33.26 75.55 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.249 -0.432 . . . . 72.0 110.909 -179.997 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -66.38 -34.89 78.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.183 -0.462 . . . . 72.34 110.861 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' MET . . . . . 0.883 ' HB3' HD23 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -70.24 -33.33 71.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 54.12 110.843 179.927 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 116' ' ' TRP . . . . . 0.602 ' CZ3' HD11 ' A' ' 226' ' ' LEU . 6.3 m95 -70.16 -42.76 72.05 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.232 -0.44 . . . . 75.23 110.898 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -72.89 -40.81 51.21 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.735 -0.745 . . . . 73.32 112.43 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.3 ptpt -61.34 -14.52 27.75 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.802 0.334 . . . . 72.42 110.897 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.641 ' HB3' HG23 ' A' ' 231' ' ' ILE . 41.9 mm-40 -100.69 13.39 35.0 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.241 -0.436 . . . . 75.24 110.838 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 1.133 HD12 HD12 ' A' ' 122' ' ' LEU . 6.6 pt -147.99 144.55 19.12 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.635 0.731 . . . . 71.34 111.099 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.72 24.57 0.17 Allowed 'Trans proline' 0 C--O 1.232 0.221 0 C-N-CA 122.673 2.249 . . . . 72.21 112.367 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 1.133 HD12 HD12 ' A' ' 120' ' ' ILE . 6.3 mt -77.46 -159.71 0.15 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.167 -0.47 . . . . 73.22 110.902 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 4.4 t-80 -151.19 120.98 7.03 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.184 -0.462 . . . . 74.12 110.934 179.852 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 11.0 m-30 -110.36 148.44 31.97 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.224 -0.443 . . . . 75.54 110.891 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.671 ' HB3' HG22 ' A' ' 90' ' ' THR . 0.0 OUTLIER -129.91 141.35 50.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.125 -0.489 . . . . 75.14 110.853 -179.872 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.14 145.25 31.13 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.247 -0.433 . . . . 72.22 110.875 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 127' ' ' VAL . . . . . 1.031 HG11 ' HB2' ' A' ' 132' ' ' ALA . 30.4 m -103.3 126.58 57.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.248 -0.433 . . . . 50.13 111.097 179.861 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.464 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -142.07 -22.62 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.116 -0.493 . . . . 74.43 111.187 179.859 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 129' ' ' TRP . . . . . 0.464 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -140.72 109.15 5.86 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.104 -0.498 . . . . 71.25 110.92 179.92 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.07 -162.24 13.53 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.747 -0.74 . . . . 62.11 112.521 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 3.2 m -101.79 156.61 17.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.79 0.329 . . . . 63.25 111.13 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' ALA . . . . . 1.031 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -111.22 165.2 12.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.218 -0.446 . . . . 51.34 111.136 179.808 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -69.05 -55.33 11.13 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.188 -0.46 . . . . 75.41 110.883 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' ILE . . . . . 0.428 HG22 ' CD1' ' A' ' 136' ' ' ILE . 41.1 mt -82.7 131.06 34.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.196 -0.456 . . . . 70.51 111.12 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 135' ' ' MET . . . . . 0.677 ' SD ' HG22 ' A' ' 94' ' ' VAL . 27.2 mmt -108.06 118.37 36.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.162 -0.472 . . . . 72.43 110.964 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.428 ' CD1' HG22 ' A' ' 134' ' ' ILE . 0.8 OUTLIER -106.16 89.87 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.316 -0.402 . . . . 70.04 111.166 179.955 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 137' ' ' GLY . . . . . 0.402 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -129.53 169.45 20.73 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.774 -0.726 . . . . 63.34 112.509 179.946 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 138' ' ' PHE . . . . . 0.605 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 45.5 m-85 -106.04 147.04 29.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.888 0.375 . . . . 74.01 110.945 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.605 ' HB2' ' O ' ' A' ' 138' ' ' PHE . . . 167.48 166.19 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.142 -0.481 . . . . 71.21 111.105 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.426 ' HB2' ' HB3' ' A' ' 149' ' ' PHE . 1.0 OUTLIER -109.28 174.36 5.9 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.216 -0.447 . . . . 62.21 110.832 -179.939 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 141' ' ' GLY . . . . . 0.547 ' H ' ' HA ' ' A' ' 149' ' ' PHE . . . -54.13 -17.68 8.07 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.783 -0.722 . . . . 74.24 112.461 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 142' ' ' ALA . . . . . 0.534 ' HB2' ' HD2' ' A' ' 149' ' ' PHE . . . -89.36 13.29 13.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.848 0.356 . . . . 75.03 111.159 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 143' ' ' HIS . . . . . 0.451 ' HB3' ' HB1' ' A' ' 139' ' ' ALA . 5.0 p80 -81.09 0.91 33.96 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.191 -0.458 . . . . 71.11 110.859 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 104.61 47.1 1.23 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.828 -0.701 . . . . 45.51 112.521 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -159.46 174.21 15.03 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.795 0.331 . . . . 72.14 110.885 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 57.7 m -63.98 176.42 0.97 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.227 -0.442 . . . . 51.25 110.848 -179.727 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 64.91 121.39 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.599 0.714 . . . . 73.4 110.908 -179.913 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.82 151.29 68.67 Favored 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.627 2.218 . . . . 74.53 112.335 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 149' ' ' PHE . . . . . 0.547 ' HA ' ' H ' ' A' ' 141' ' ' GLY . 1.5 p90 -53.93 -30.22 45.51 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.192 -0.458 . . . . 63.52 110.931 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 150' ' ' ASP . . . . . 0.518 ' CG ' ' O ' ' A' ' 149' ' ' PHE . 2.9 p30 50.03 15.45 0.18 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.135 -0.484 . . . . 63.11 110.851 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 151' ' ' GLY . . . . . 0.407 ' C ' ' O ' ' A' ' 150' ' ' ASP . . . 37.5 -154.64 0.01 OUTLIER Glycine 0 N--CA 1.453 -0.228 0 C-N-CA 120.698 -0.763 . . . . 71.41 112.518 -179.925 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 143.51 51.25 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.627 2.218 . . . . 75.11 112.389 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 153' ' ' GLY . . . . . 0.448 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 105.0 -132.14 10.96 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.809 -0.71 . . . . 70.32 112.493 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 154' ' ' ASN . . . . . 0.448 ' C ' ' O ' ' A' ' 153' ' ' GLY . 2.7 p30 -34.62 142.51 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.954 0.407 . . . . 73.25 110.907 -179.925 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 155' ' ' THR . . . . . 0.594 HG22 ' HA3' ' A' ' 68' ' ' GLY . 0.3 OUTLIER 69.59 110.06 0.05 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.21 -0.45 . . . . 44.41 111.16 -179.921 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 156' ' ' LEU . . . . . 0.985 HD21 HG21 ' A' ' 186' ' ' ILE . 0.6 OUTLIER -87.97 -54.5 4.2 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.15 -0.477 . . . . 75.02 110.947 179.965 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 157' ' ' ALA . . . . . 0.575 ' HB1' ' O ' ' A' ' 171' ' ' HIS . . . -163.84 149.18 10.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.209 -0.451 . . . . 71.42 111.092 179.805 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 33.9 p-80 -108.1 123.36 48.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.2 -0.455 . . . . 72.02 110.771 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.45 ' H ' HG22 ' A' ' 69' ' ' VAL . . . -111.05 160.23 17.04 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.154 -0.475 . . . . 74.42 111.152 179.897 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -110.89 150.77 28.71 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.285 -0.416 . . . . 75.31 110.892 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 161' ' ' ALA . . . . . 0.624 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -79.26 162.1 65.27 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.607 0.718 . . . . 61.04 111.116 179.915 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 162' ' ' PRO . . . . . 0.624 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.5 Cg_endo -69.74 77.82 1.04 Allowed 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.704 2.269 . . . . 74.44 112.315 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -135.18 121.5 2.59 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.697 -0.763 . . . . 61.41 112.52 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 62.61 -173.64 0.15 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.817 0.342 . . . . 73.1 111.144 -179.825 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -79.09 -49.79 6.17 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.815 -0.707 . . . . 74.03 112.527 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 166' ' ' LEU . . . . . 0.585 HD23 ' O ' ' A' ' 166' ' ' LEU . 6.1 tt -63.78 -37.17 86.37 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.863 0.363 . . . . 65.12 110.874 -179.893 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -79.18 157.5 42.97 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.725 -0.75 . . . . 43.43 112.454 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 94.42 22.9 23.22 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.719 -0.753 . . . . 74.31 112.542 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 80.6 m-20 -94.4 168.49 10.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.877 0.37 . . . . 63.41 110.789 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -117.11 130.83 56.89 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.124 -0.489 . . . . 74.21 111.042 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 171' ' ' HIS . . . . . 0.575 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 28.1 m170 -126.11 132.14 51.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.2 -0.454 . . . . 72.53 110.85 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 32.3 m-85 -113.75 139.97 48.66 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.214 -0.448 . . . . 71.44 110.876 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 55.3 t0 -71.56 100.25 2.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.112 -0.494 . . . . 74.11 110.831 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.62 -16.53 10.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.227 -0.442 . . . . 72.25 110.823 -179.87 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -78.46 -16.19 57.81 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.208 -0.451 . . . . 73.32 110.806 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -83.59 -174.54 5.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.255 -0.43 . . . . 63.2 110.969 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 12.9 mtm180 -113.23 116.95 30.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.207 -0.451 . . . . 63.14 110.907 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 44.2 m95 -116.86 137.44 52.21 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.235 -0.439 . . . . 72.31 110.897 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 179' ' ' THR . . . . . 0.567 HG21 ' HB3' ' A' ' 182' ' ' SER . 5.0 t -176.58 163.69 2.42 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.219 -0.446 . . . . 74.13 111.143 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -123.99 -68.69 0.85 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.204 -0.453 . . . . 45.33 110.842 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -66.8 -10.84 56.46 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.755 -0.736 . . . . 62.41 112.492 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 182' ' ' SER . . . . . 0.567 ' HB3' HG21 ' A' ' 179' ' ' THR . 0.3 OUTLIER -96.59 -24.32 16.09 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.912 0.387 . . . . 64.5 110.915 -179.781 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 183' ' ' SER . . . . . 0.448 ' C ' ' O ' ' A' ' 182' ' ' SER . 97.4 p 34.02 63.3 0.41 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.131 -0.486 . . . . 64.12 110.825 -179.9 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 24.8 tp -116.91 -33.64 4.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.18 -0.464 . . . . 74.2 110.889 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -124.51 -135.76 4.49 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.699 -0.762 . . . . 73.01 112.484 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 186' ' ' ILE . . . . . 0.985 HG21 HD21 ' A' ' 156' ' ' LEU . 7.1 mm -79.36 100.09 3.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.775 0.322 . . . . 73.22 111.162 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -50.75 123.79 9.72 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.131 -0.486 . . . . 71.31 110.816 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 188' ' ' PHE . . . . . 0.772 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.6 t80 -54.03 -35.42 61.94 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.121 -0.49 . . . . 75.45 110.873 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 189' ' ' LEU . . . . . 0.565 HD12 ' HE2' ' A' ' 224' ' ' PHE . 0.2 OUTLIER -67.27 -47.11 71.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.122 -0.49 . . . . 52.02 110.955 179.964 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.16 -40.86 77.92 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.234 -0.439 . . . . 74.22 110.934 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 191' ' ' ALA . . . . . 0.602 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -70.16 -35.05 73.73 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.128 -0.487 . . . . 50.03 111.079 179.847 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 192' ' ' ALA . . . . . 0.707 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -56.81 -43.24 80.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.216 -0.447 . . . . 52.11 111.102 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 193' ' ' THR . . . . . 0.504 HG21 HG21 ' A' ' 211' ' ' VAL . 0.0 OUTLIER -57.86 -42.63 84.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.21 -0.45 . . . . 72.43 111.117 -179.891 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 5.7 t-160 -73.46 -40.23 64.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.182 -0.463 . . . . 71.44 110.905 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -70.69 -48.85 52.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.139 -0.482 . . . . 71.01 111.059 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 196' ' ' LEU . . . . . 0.707 HD23 ' O ' ' A' ' 192' ' ' ALA . 4.2 mm? -64.04 -46.6 83.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 74.51 110.939 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -55.06 -31.97 56.36 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.74 -0.743 . . . . 52.23 112.429 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 198' ' ' HIS . . . . . 0.694 ' CD2' HG21 ' A' ' 69' ' ' VAL . 4.5 m-70 -65.54 -36.42 83.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.855 0.36 . . . . 75.21 110.826 -179.898 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 29.9 t -67.38 -21.05 65.63 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.187 -0.46 . . . . 71.13 110.871 -179.755 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -90.31 -0.07 57.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.141 -0.482 . . . . 64.13 110.935 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 85.01 -7.89 72.83 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.692 -0.766 . . . . 50.41 112.449 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 202' ' ' MET . . . . . . . . . . . . . 28.3 tpp -50.05 139.36 14.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.797 0.332 . . . . 63.21 110.966 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -101.17 159.08 18.85 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.776 -0.726 . . . . 64.44 112.535 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 204' ' ' HIS . . . . . 0.407 ' HA ' ' HB3' ' A' ' 212' ' ' MET . 22.5 m-70 -56.99 154.81 9.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.791 0.329 . . . . 74.32 110.851 -179.901 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -119.3 145.05 46.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.234 -0.439 . . . . 53.34 110.852 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 206' ' ' SER . . . . . 0.457 ' HB3' ' HA2' ' A' ' 47' ' ' GLY . 1.7 m -87.97 -4.26 58.83 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.155 -0.475 . . . . 72.22 110.805 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 207' ' ' ASP . . . . . 0.411 ' HB2' ' HB2' ' A' ' 210' ' ' ALA . 0.6 OUTLIER -71.38 137.7 83.85 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.635 0.731 . . . . 65.11 110.835 179.998 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -69.71 -9.84 27.11 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.704 2.269 . . . . 74.53 112.368 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 -122.01 24.72 9.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.145 -0.479 . . . . 63.52 110.858 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 210' ' ' ALA . . . . . 0.439 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.33 145.17 26.44 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.185 -0.461 . . . . 62.23 111.092 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 211' ' ' VAL . . . . . 0.504 HG21 HG21 ' A' ' 193' ' ' THR . 0.3 OUTLIER -69.5 -27.71 35.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.185 -0.461 . . . . 62.04 111.163 179.925 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 212' ' ' MET . . . . . 0.407 ' HB3' ' HA ' ' A' ' 204' ' ' HIS . 0.0 OUTLIER -92.1 3.65 54.83 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.205 -0.452 . . . . 75.22 110.841 179.935 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 213' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -55.54 110.43 2.25 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-O 121.652 0.739 . . . . 73.43 110.934 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 -18.07 37.17 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.685 2.257 . . . . 63.01 112.31 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -84.11 58.1 4.57 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.247 -0.433 . . . . 74.24 111.136 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -51.48 128.32 22.53 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.246 -0.434 . . . . 74.14 110.907 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . 147.19 52.13 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.759 -0.734 . . . . 74.22 112.489 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 7.5 p30 -122.83 -177.61 3.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.827 0.346 . . . . 64.22 110.921 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . -51.85 157.16 3.4 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.742 -0.742 . . . . 72.24 112.498 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 220' ' ' ASP . . . . . 0.403 ' HA ' ' HD2' ' A' ' 221' ' ' PRO . 0.7 OUTLIER -102.58 101.44 20.27 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-O 121.589 0.709 . . . . 41.43 110.883 -179.991 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 221' ' ' PRO . . . . . 0.403 ' HD2' ' HA ' ' A' ' 220' ' ' ASP . 53.8 Cg_endo -69.81 168.56 21.27 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.7 2.266 . . . . 73.42 112.326 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -75.12 -44.91 44.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.236 -0.438 . . . . 74.21 110.954 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -126.77 -39.99 1.94 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.176 -0.465 . . . . 60.33 110.952 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 224' ' ' PHE . . . . . 0.565 ' HE2' HD12 ' A' ' 189' ' ' LEU . 0.0 OUTLIER 66.08 137.59 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.162 -0.472 . . . . 65.01 110.922 -179.997 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -143.23 -167.74 2.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.109 -0.496 . . . . 64.24 110.905 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 226' ' ' LEU . . . . . 0.883 HD23 ' HB3' ' A' ' 115' ' ' MET . 0.5 OUTLIER -59.3 148.67 31.32 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.208 -0.451 . . . . 53.44 110.902 179.935 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 227' ' ' SER . . . . . 0.439 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 2.0 t -87.12 157.4 19.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.192 -0.458 . . . . 74.21 110.926 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -63.44 -63.07 1.28 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.12 -0.491 . . . . 74.54 110.871 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -55.74 -27.77 52.4 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.212 -0.449 . . . . 72.22 110.897 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.22 -48.51 61.76 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.275 -0.42 . . . . 74.23 110.805 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 231' ' ' ILE . . . . . 0.665 HD11 ' HB3' ' A' ' 226' ' ' LEU . 8.3 mt -68.23 -43.07 84.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.213 -0.449 . . . . 73.41 111.1 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 11.8 pttp -66.09 -33.03 74.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.157 -0.474 . . . . 65.42 110.91 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -63.18 -46.78 92.41 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.784 -0.722 . . . . 63.43 112.435 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 7.0 tt -72.9 -30.77 33.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.74 0.305 . . . . 71.54 111.066 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -65.87 -24.3 66.84 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.214 -0.448 . . . . 70.33 110.862 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 236' ' ' LYS . . . . . 0.405 ' HE2' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.64 -28.29 60.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.259 -0.428 . . . . 51.21 110.913 179.992 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 237' ' ' LEU . . . . . 0.844 HD22 ' HD2' ' A' ' 83' ' ' LYS . 7.0 tt -97.77 -31.0 12.46 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.2 -0.455 . . . . 75.41 110.892 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 238' ' ' TYR . . . . . 0.417 ' OH ' HD11 ' A' ' 122' ' ' LEU . 3.7 m-85 -91.85 -35.21 14.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.19 -0.459 . . . . 51.24 110.875 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -127.41 -120.17 2.31 Favored Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.691 -0.766 . . . . 32.22 112.453 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 2.0 mttm -98.07 144.91 27.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.842 0.353 . . . . 75.42 110.841 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.57 168.95 11.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.231 -0.441 . . . . 73.34 110.926 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -140.48 -43.12 0.41 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.28 -0.418 . . . . 62.42 110.868 -179.845 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -165.6 123.23 1.51 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.184 -0.462 . . . . 72.13 110.886 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -54.23 172.59 0.09 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.13 -0.486 . . . . 62.23 110.879 -179.812 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -164.89 163.02 21.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.155 -0.475 . . . . 70.43 110.881 -179.862 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.76 163.07 20.42 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.197 -0.456 . . . . 72.11 110.892 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 1.5 ptpt . . . . . 0 C--N 1.33 -0.267 0 CA-C-N 116.167 -0.47 . . . . 74.13 110.827 179.902 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 302' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' -2' ' ' LEU . . . . . 0.489 ' N ' ' HD2' ' A' ' -1' ' ' PRO . 2.3 mt . . . . . 0 C--O 1.232 0.136 0 CA-C-O 121.594 0.711 . . . . 73.02 110.889 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' -1' ' ' PRO . . . . . 0.489 ' HD2' ' N ' ' A' ' -2' ' ' LEU . 53.0 Cg_endo -69.87 96.11 0.59 Allowed 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.635 2.224 . . . . 71.15 112.288 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 0' ' ' LEU . . . . . 0.49 ' N ' ' HD2' ' A' ' 1' ' ' PRO . 0.3 OUTLIER -68.58 -60.43 4.72 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.587 0.708 . . . . 62.13 110.888 179.972 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.49 ' HD2' ' N ' ' A' ' 0' ' ' LEU . 53.4 Cg_endo -69.75 -176.39 1.47 Allowed 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.694 2.263 . . . . 64.14 112.31 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -113.98 130.31 56.54 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.236 -0.438 . . . . 60.51 110.926 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -95.12 -25.27 16.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.142 -0.481 . . . . 74.01 110.891 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.58 -34.05 66.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.142 -0.481 . . . . 71.4 111.094 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -55.76 -37.98 71.23 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.746 -0.74 . . . . 60.51 112.532 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -108.94 20.89 28.35 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.754 -0.736 . . . . 54.22 112.475 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 7.5 mtt -82.9 161.32 21.9 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.771 0.32 . . . . 72.23 110.908 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.3 p -115.57 168.65 9.82 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.25 -0.432 . . . . 73.24 110.819 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -54.36 -31.87 55.59 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.103 -0.498 . . . . 50.12 110.916 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.79 -42.74 97.69 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.151 -0.477 . . . . 72.33 110.862 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -63.02 -42.2 99.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.231 -0.44 . . . . 72.14 110.925 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 3.4 t-105 -72.94 -37.16 67.25 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.159 -0.473 . . . . 71.22 110.917 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 41.1 mm-40 -71.17 -35.49 71.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.271 -0.422 . . . . 72.51 110.926 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 5.8 mm-40 -68.85 -37.13 78.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.098 -0.501 . . . . 61.24 110.88 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.459 ' HB1' ' HE3' ' A' ' 62' ' ' MET . . . -57.21 -36.95 71.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.2 -0.454 . . . . 54.34 111.059 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.51 HE21 ' HG2' ' A' ' 30' ' ' LYS . 42.0 tt0 -69.87 -42.96 72.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.21 -0.45 . . . . 73.12 110.931 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.413 ' HA ' ' HD2' ' A' ' 20' ' ' LYS . 35.6 m-20 -65.21 -31.56 72.79 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.46 . . . . 72.4 110.808 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 17.5 m-85 -70.42 -36.6 74.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.214 -0.448 . . . . 75.11 110.979 -179.836 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.634 HD13 ' O ' ' A' ' 19' ' ' LEU . 3.2 tm? -72.01 -26.32 62.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.063 -0.517 . . . . 72.51 110.923 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.413 ' HD2' ' HA ' ' A' ' 17' ' ' ASP . 5.0 ptmt -67.6 -32.18 72.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.175 -0.466 . . . . 74.41 110.882 179.86 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.8 ptp85 -85.91 -26.74 25.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.251 -0.432 . . . . 74.05 110.82 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -74.51 2.36 9.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.255 -0.429 . . . . 74.31 110.868 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.549 ' CE1' HD12 ' A' ' 24' ' ' LEU . 60.3 t80 -118.26 -75.93 0.58 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.154 -0.475 . . . . 72.55 110.947 -179.818 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.549 HD12 ' CE1' ' A' ' 23' ' ' TYR . 95.1 mt -156.7 22.11 0.33 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.067 -0.515 . . . . 75.43 110.912 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 4.3 t80 49.48 89.69 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.277 -0.42 . . . . 71.41 110.945 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -125.25 115.28 20.13 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.051 -0.522 . . . . 74.25 110.842 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 58.5 p -83.58 -6.56 59.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.261 -0.427 . . . . 62.15 110.845 -179.777 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -91.69 -22.58 20.16 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.186 -0.461 . . . . 74.51 110.908 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.721 HG21 ' HD3' ' A' ' 38' ' ' LYS . 11.7 m -76.92 -18.77 58.07 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.124 -0.489 . . . . 70.44 111.143 -179.885 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.51 ' HG2' HE21 ' A' ' 16' ' ' GLN . 0.1 OUTLIER -55.29 100.65 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.24 -0.436 . . . . 73.33 110.898 179.873 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -179.23 155.15 0.7 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 64.43 110.887 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.98 -33.87 70.85 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.179 -0.464 . . . . 70.21 111.128 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 16.4 m-20 -67.85 -40.19 83.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.161 -0.472 . . . . 35.31 110.897 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 5.1 m -86.12 -20.09 29.2 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.149 -0.478 . . . . 74.02 110.881 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.507 HD22 ' OE1' ' A' ' 16' ' ' GLN . 31.1 tp -58.01 -45.19 87.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.089 -0.505 . . . . 72.52 110.861 -179.946 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -57.64 -46.06 84.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.295 -0.412 . . . . 73.13 110.821 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.56 -36.68 84.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.133 -0.485 . . . . 63.32 111.108 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.721 ' HD3' HG21 ' A' ' 29' ' ' THR . 11.8 mtmt -70.38 -49.31 50.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.171 -0.468 . . . . 72.32 110.845 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.487 HD11 HD22 ' A' ' 54' ' ' LEU . 5.1 mt -59.79 -35.77 75.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.287 -0.415 . . . . 72.11 110.881 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.1 ttmt -58.15 -46.25 85.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.198 -0.455 . . . . 62.43 110.912 179.813 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -70.37 -36.4 74.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 75.11 110.869 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.9 ttp -69.4 -36.48 76.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.173 -0.467 . . . . 63.43 110.849 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.597 ' HG2' HD11 ' A' ' 48' ' ' LEU . 3.2 mt-30 -66.91 -43.34 83.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.166 -0.47 . . . . 74.45 110.987 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.558 ' HD2' ' N ' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -73.11 -20.83 60.85 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.191 -0.459 . . . . 71.43 110.921 179.886 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.558 ' N ' ' HD2' ' A' ' 44' ' ' LYS . 89.1 t80 -71.22 -37.6 72.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.241 -0.436 . . . . 73.32 110.945 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.833 ' CZ ' HD13 ' A' ' 61' ' ' ILE . 6.1 m-85 -81.91 -28.4 32.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.109 -0.496 . . . . 70.43 110.841 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 106.45 -10.44 42.48 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.723 -0.751 . . . . 64.34 112.538 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.597 HD11 ' HG2' ' A' ' 43' ' ' GLN . 0.9 OUTLIER -63.47 138.61 97.41 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.65 0.738 . . . . 64.11 110.863 -179.858 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.84 -54.04 0.24 Allowed 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.664 2.243 . . . . 74.5 112.38 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.689 HD11 ' HB3' ' A' ' 57' ' ' ARG . 0.7 OUTLIER -50.08 107.97 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.24 -0.436 . . . . 71.22 111.074 179.931 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 3.6 p -111.0 167.07 10.53 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.197 -0.456 . . . . 73.25 111.174 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 57.68 19.59 35.99 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.739 -0.743 . . . . 64.24 112.538 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.1 mtt -119.55 161.09 21.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.795 0.331 . . . . 75.23 110.883 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.487 HD22 HD11 ' A' ' 39' ' ' LEU . 26.2 tp -164.35 85.38 0.44 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.27 -0.423 . . . . 73.4 110.99 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.424 ' HA ' HG13 ' A' ' 59' ' ' ILE . 0.9 OUTLIER 175.52 -29.17 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.188 -0.46 . . . . 44.35 110.86 179.907 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 23.5 m -89.77 -101.29 0.1 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.235 -0.439 . . . . 75.25 110.811 -179.826 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.689 ' HB3' HD11 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -84.79 -28.54 26.09 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.125 -0.489 . . . . 61.22 110.927 -179.944 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.654 HG23 HD12 ' A' ' 50' ' ' ILE . 43.6 t -64.63 -42.69 95.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.125 -0.489 . . . . 70.12 111.12 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.424 HG13 ' HA ' ' A' ' 55' ' ' ASN . 1.5 mm -74.61 -31.43 27.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.161 -0.472 . . . . 74.43 111.127 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -58.97 -40.16 83.93 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.15 -0.477 . . . . 73.45 110.913 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.833 HD13 ' CZ ' ' A' ' 46' ' ' PHE . 1.2 pp -68.17 -28.98 42.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.088 -0.505 . . . . 74.52 111.124 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.459 ' HE3' ' HB1' ' A' ' 15' ' ' ALA . 3.3 mmt -60.54 -40.19 90.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.182 -0.463 . . . . 74.01 110.891 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -84.46 -23.76 29.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.219 -0.446 . . . . 42.22 110.892 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.37 112.1 41.59 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.533 0.682 . . . . 65.34 110.873 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 151.8 69.12 Favored 'Trans proline' 0 N--CA 1.465 -0.188 0 C-N-CA 122.707 2.271 . . . . 72.11 112.367 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -145.75 -68.84 0.28 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.217 -0.447 . . . . 71.51 110.843 -179.939 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -145.21 151.89 39.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.243 -0.435 . . . . 55.3 110.889 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.652 ' HA2' HG23 ' A' ' 155' ' ' THR . . . -88.02 4.27 85.59 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.742 -0.742 . . . . 64.23 112.495 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.49 HG21 ' CD2' ' A' ' 198' ' ' HIS . 0.2 OUTLIER -92.89 135.24 26.28 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.645 0.735 . . . . 74.23 111.111 -179.912 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.486 ' HD2' HG12 ' A' ' 69' ' ' VAL . 53.6 Cg_endo -69.78 151.93 69.1 Favored 'Trans proline' 0 C--O 1.231 0.143 0 C-N-CA 122.679 2.253 . . . . 63.44 112.321 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -58.91 -30.86 68.13 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.166 -0.47 . . . . 74.45 110.864 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.544 HG11 ' CE2' ' A' ' 23' ' ' TYR . 8.9 m -110.91 129.13 66.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.208 -0.451 . . . . 53.43 111.111 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -130.84 170.42 14.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.203 -0.453 . . . . 73.13 111.17 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -172.59 154.93 3.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.283 -0.417 . . . . 73.31 110.889 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -170.25 165.34 9.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.157 -0.474 . . . . 70.41 110.884 -179.834 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -51.84 160.29 0.71 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.111 -0.495 . . . . 74.2 110.804 -179.811 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.3 tp -95.41 32.82 1.69 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.064 -0.516 . . . . 70.34 110.903 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' PHE . . . . . 0.489 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 0.7 OUTLIER -68.88 -60.62 4.25 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.588 0.709 . . . . 71.24 110.861 179.95 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.489 ' HD2' ' N ' ' A' ' 78' ' ' PHE . 53.4 Cg_endo -69.72 117.36 5.03 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.681 2.254 . . . . 73.34 112.33 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -51.52 123.13 9.19 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.24 -0.437 . . . . 74.43 110.932 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 63.48 155.64 0.12 Allowed Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.628 0.728 . . . . 70.4 110.902 -179.815 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 -49.28 0.58 Allowed 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.688 2.259 . . . . 71.11 112.319 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.644 ' HD2' HD22 ' A' ' 237' ' ' LEU . 20.4 mttp -78.31 161.16 27.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.263 -0.426 . . . . 64.45 110.849 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' TRP . . . . . 0.432 ' CD1' ' HA ' ' A' ' 200' ' ' LEU . 27.2 m95 -49.88 116.42 1.8 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.217 -0.447 . . . . 73.31 110.906 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.434 HG22 ' O ' ' A' ' 85' ' ' THR . 6.4 m -115.17 1.05 13.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.262 -0.427 . . . . 65.3 111.132 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.8 m -66.33 -176.61 0.45 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.197 -0.456 . . . . 70.34 110.842 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 4.0 mttt -92.07 -23.08 19.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.102 -0.499 . . . . 71.12 110.94 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -154.29 143.49 13.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.226 -0.443 . . . . 74.14 111.064 179.866 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 99.6 t -117.81 130.36 72.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.142 -0.481 . . . . 72.25 111.119 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.644 HG22 ' HB3' ' A' ' 125' ' ' ARG . 28.8 p -122.09 162.34 21.42 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.16 -0.473 . . . . 71.01 111.157 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 4.0 p90 -151.24 146.59 26.17 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.223 -0.444 . . . . 70.51 110.932 -179.877 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 10.4 ttt180 -148.36 135.88 20.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.124 -0.489 . . . . 71.25 110.899 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.405 HG13 ' HB ' ' A' ' 136' ' ' ILE . 3.9 mp -74.82 135.46 27.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.205 -0.452 . . . . 72.4 111.173 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.417 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 19.9 t -90.33 -40.48 12.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.19 -0.459 . . . . 60.2 111.105 179.909 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 40.9 t -144.16 164.45 30.65 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.174 -0.466 . . . . 64.24 110.863 -179.802 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 6.1 p90 -111.47 153.41 26.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.159 -0.473 . . . . 72.25 110.958 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.486 ' OG1' HG21 ' A' ' 105' ' ' VAL . 0.2 OUTLIER -82.61 140.97 32.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.128 -0.487 . . . . 64.11 111.136 -179.949 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 10.8 ptp180 -73.21 -7.88 53.38 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.214 -0.448 . . . . 72.14 110.893 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -96.42 -26.05 15.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.232 -0.44 . . . . 74.13 110.927 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.614 HD21 ' HA ' ' A' ' 179' ' ' THR . 0.5 OUTLIER -133.55 153.75 80.44 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.57 0.7 . . . . 72.52 110.928 -179.936 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 101' ' ' PRO . . . . . 0.603 ' HB2' HG22 ' A' ' 103' ' ' ILE . 54.5 Cg_endo -69.7 150.9 69.16 Favored 'Trans proline' 0 N--CA 1.465 -0.187 0 C-N-CA 122.744 2.296 . . . . 73.11 112.359 179.825 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 16.3 t-160 -53.22 -25.79 15.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.304 -0.407 . . . . 74.11 110.817 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.603 HG22 ' HB2' ' A' ' 101' ' ' PRO . 15.2 tt -76.62 -39.15 31.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.449 . . . . 74.02 111.119 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' THR . . . . . 0.664 ' O ' HD22 ' A' ' 108' ' ' LEU . 3.3 m -69.2 -38.91 78.86 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.166 -0.47 . . . . 52.11 111.157 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.733 ' O ' HG13 ' A' ' 109' ' ' VAL . 97.3 t -72.72 -44.85 58.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.172 -0.467 . . . . 71.51 111.111 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.685 ' O ' HG22 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -66.27 -41.79 89.39 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.257 -0.429 . . . . 63.44 110.851 179.893 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -70.04 -34.23 72.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 75.02 110.909 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.664 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -61.05 -48.1 83.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.162 -0.472 . . . . 71.04 110.935 -179.991 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.733 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.4 m -55.37 -41.37 61.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.218 -0.446 . . . . 72.31 111.095 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.463 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 32.1 t -70.08 -33.8 72.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.17 -0.468 . . . . 72.14 110.894 -179.807 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.41 ' CG ' HD21 ' A' ' 189' ' ' LEU . 0.3 OUTLIER -62.28 -33.26 74.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.09 -0.504 . . . . 74.35 110.873 179.951 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -95.68 -40.53 9.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.219 -0.446 . . . . 74.32 111.114 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.722 ' CD1' HD12 ' A' ' 196' ' ' LEU . 0.4 OUTLIER -65.32 -32.8 74.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.263 -0.426 . . . . 72.0 110.954 -179.984 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 15.4 t30 -65.49 -39.85 92.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.172 -0.467 . . . . 72.34 110.887 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' MET . . . . . 0.777 ' O ' HD11 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -59.85 -34.95 73.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.107 -0.497 . . . . 54.12 110.868 179.951 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 116' ' ' TRP . . . . . 0.429 ' CG ' HD11 ' A' ' 200' ' ' LEU . 28.2 m95 -66.59 -52.28 47.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.282 -0.417 . . . . 75.23 110.947 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -60.13 -36.17 89.79 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.754 -0.736 . . . . 73.32 112.45 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.3 mmpt? -64.67 -14.09 56.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.724 0.297 . . . . 72.42 110.95 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.457 ' HG2' HG23 ' A' ' 120' ' ' ILE . 0.6 OUTLIER -99.11 -13.81 19.64 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.226 -0.443 . . . . 75.24 110.873 179.974 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 1.12 HD12 HD12 ' A' ' 122' ' ' LEU . 6.9 pt -122.79 142.92 38.95 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.619 0.723 . . . . 71.34 111.121 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.8 8.54 0.75 Allowed 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.708 2.272 . . . . 72.21 112.364 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 1.12 HD12 HD12 ' A' ' 120' ' ' ILE . 16.4 mt -61.26 -163.17 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.216 -0.447 . . . . 73.22 110.938 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.401 ' H ' ' HB3' ' A' ' 122' ' ' LEU . 12.2 t-80 -144.87 122.98 12.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.196 -0.457 . . . . 74.12 110.861 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 9.2 m-30 -107.49 141.47 38.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 75.54 110.86 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.644 ' HB3' HG22 ' A' ' 90' ' ' THR . 0.0 OUTLIER -125.93 141.63 51.88 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.164 -0.471 . . . . 75.14 110.911 -179.931 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.85 152.5 28.15 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.263 -0.426 . . . . 72.22 110.876 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 127' ' ' VAL . . . . . 0.893 HG11 ' HB2' ' A' ' 132' ' ' ALA . 29.3 m -103.17 126.24 57.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.176 -0.466 . . . . 50.13 111.137 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.606 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -144.9 -11.08 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.151 -0.477 . . . . 74.43 111.126 179.994 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 129' ' ' TRP . . . . . 0.606 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -157.0 109.24 2.46 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.166 -0.47 . . . . 71.25 110.869 -179.996 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 108.22 -162.49 13.06 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.726 -0.749 . . . . 62.11 112.505 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.88 156.35 17.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.79 0.328 . . . . 63.25 111.132 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 132' ' ' ALA . . . . . 0.893 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -111.62 165.28 12.15 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.196 -0.456 . . . . 51.34 111.109 179.852 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -73.41 -55.1 6.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 75.41 110.819 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' ILE . . . . . 0.439 HD12 ' N ' ' A' ' 134' ' ' ILE . 4.8 mp -92.68 107.48 19.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.205 -0.452 . . . . 70.51 111.143 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 135' ' ' MET . . . . . 0.417 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 14.0 mmm -91.54 128.18 37.27 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.207 -0.451 . . . . 72.43 110.887 179.849 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.405 ' HB ' HG13 ' A' ' 93' ' ' ILE . 0.6 OUTLIER -106.13 94.74 3.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.263 -0.426 . . . . 70.04 111.098 179.976 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -134.59 160.56 24.27 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.732 -0.747 . . . . 63.34 112.47 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 138' ' ' PHE . . . . . 0.571 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 49.2 m-85 -105.08 149.53 25.76 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.82 0.343 . . . . 74.01 110.912 -179.887 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.571 ' HB2' ' O ' ' A' ' 138' ' ' PHE . . . 169.43 166.83 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.203 -0.453 . . . . 71.21 111.074 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -104.44 173.27 6.38 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.189 -0.459 . . . . 62.21 110.928 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -55.36 -17.1 11.2 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.72 -0.753 . . . . 74.24 112.524 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -88.3 12.93 12.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.829 0.347 . . . . 75.03 111.109 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 5.9 p80 -80.67 -22.11 40.73 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.184 -0.462 . . . . 71.11 110.939 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 139.34 38.7 0.1 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.808 -0.71 . . . . 45.51 112.495 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 54.1 p-10 -150.18 152.01 33.98 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.823 0.344 . . . . 72.14 110.869 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 96.0 p -73.4 -179.74 3.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.175 -0.466 . . . . 51.25 110.861 -179.747 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 68.6 121.08 0.03 OUTLIER Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.659 0.742 . . . . 73.4 110.897 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.75 144.88 55.52 Favored 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 122.665 2.243 . . . . 74.53 112.391 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 149' ' ' PHE . . . . . 0.424 ' CE1' ' HB2' ' A' ' 173' ' ' ASP . 0.1 OUTLIER -90.89 -32.78 15.89 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.182 -0.463 . . . . 63.52 110.926 -179.975 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 73.88 -1.26 3.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.158 -0.474 . . . . 63.11 110.859 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 151' ' ' GLY . . . . . 0.641 ' O ' 'CA ' ' A' ' 302' ' ' ' CA' . . . 49.58 -108.37 0.44 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.809 -0.71 . . . . 71.41 112.504 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.84 139.61 40.37 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.58 2.186 . . . . 75.11 112.419 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 103.23 -155.16 18.08 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.745 -0.741 . . . . 70.32 112.497 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 154' ' ' ASN . . . . . 0.436 ' O ' ' CB ' ' A' ' 155' ' ' THR . 2.9 p30 -42.06 153.75 0.06 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.989 0.423 . . . . 73.25 110.857 -179.834 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 155' ' ' THR . . . . . 0.652 HG23 ' HA2' ' A' ' 68' ' ' GLY . 1.2 m 80.15 114.53 0.06 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.149 -0.478 . . . . 44.41 111.155 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 156' ' ' LEU . . . . . 1.085 HD21 HG21 ' A' ' 186' ' ' ILE . 0.7 OUTLIER -99.72 -51.64 3.68 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.255 -0.43 . . . . 75.02 110.984 179.928 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 157' ' ' ALA . . . . . 0.552 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -163.4 148.11 11.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.176 -0.465 . . . . 71.42 111.12 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 21.3 p-80 -108.13 124.92 50.98 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.257 -0.428 . . . . 72.02 110.873 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.446 ' H ' HG22 ' A' ' 69' ' ' VAL . . . -110.73 156.26 21.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.239 -0.437 . . . . 74.42 111.065 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 13.0 m-30 -117.05 150.89 37.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.208 -0.451 . . . . 75.31 110.864 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 161' ' ' ALA . . . . . 0.71 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -79.87 164.55 52.52 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 121.591 0.71 . . . . 61.04 111.078 179.907 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 162' ' ' PRO . . . . . 0.71 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.7 Cg_endo -69.76 78.38 1.01 Allowed 'Trans proline' 0 C--N 1.341 0.156 0 C-N-CA 122.707 2.271 . . . . 74.44 112.316 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -140.29 128.55 3.88 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.722 -0.752 . . . . 61.41 112.507 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 64.64 -169.96 0.2 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.848 0.356 . . . . 73.1 111.113 -179.87 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -85.63 -49.86 4.2 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.727 -0.749 . . . . 74.03 112.483 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 166' ' ' LEU . . . . . 0.648 HD23 ' O ' ' A' ' 166' ' ' LEU . 8.2 tt -68.14 -27.52 66.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.869 0.366 . . . . 65.12 110.947 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -84.04 159.92 36.34 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.801 -0.714 . . . . 43.43 112.467 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 88.26 23.07 38.69 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.766 -0.731 . . . . 74.31 112.498 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 -101.14 164.4 11.81 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.862 0.363 . . . . 63.41 110.83 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.13 130.44 55.9 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.16 -0.473 . . . . 74.21 111.118 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 171' ' ' HIS . . . . . 0.439 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 21.2 m170 -125.9 158.54 34.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.242 -0.435 . . . . 72.53 110.81 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -139.45 139.09 36.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.176 -0.466 . . . . 71.44 110.898 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 173' ' ' ASP . . . . . 0.424 ' HB2' ' CE1' ' A' ' 149' ' ' PHE . 67.1 t0 -67.65 97.61 0.63 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.165 -0.47 . . . . 74.11 110.863 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.05 -16.05 11.44 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.137 -0.483 . . . . 72.25 110.905 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -79.16 -16.42 56.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.135 -0.484 . . . . 73.32 110.832 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 37.2 mm-40 -83.17 -173.66 4.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.158 -0.474 . . . . 63.2 110.927 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 78.7 mtt180 -110.33 110.92 21.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.222 -0.445 . . . . 63.14 110.935 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 68.1 m95 -110.86 134.39 52.58 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.196 -0.456 . . . . 72.31 110.957 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 179' ' ' THR . . . . . 0.614 ' HA ' HD21 ' A' ' 100' ' ' LEU . 7.4 t -177.28 163.62 2.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.225 -0.443 . . . . 74.13 111.077 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -125.22 -70.25 0.75 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.165 -0.471 . . . . 45.33 110.847 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -63.06 -13.42 48.43 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.804 -0.712 . . . . 62.41 112.529 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 182' ' ' SER . . . . . 0.508 ' HB3' HG21 ' A' ' 179' ' ' THR . 0.3 OUTLIER -93.1 -24.44 18.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.885 0.374 . . . . 64.5 110.89 -179.739 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 183' ' ' SER . . . . . 0.418 ' C ' ' O ' ' A' ' 182' ' ' SER . 89.5 p 36.04 58.53 0.95 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 64.12 110.866 -179.814 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -116.85 -33.48 4.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.154 -0.475 . . . . 74.2 110.894 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -119.52 -138.58 5.76 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.713 -0.756 . . . . 73.01 112.491 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 186' ' ' ILE . . . . . 1.085 HG21 HD21 ' A' ' 156' ' ' LEU . 9.2 mm -79.49 102.98 5.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 120.798 0.332 . . . . 73.22 111.115 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -48.96 119.54 3.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.202 -0.454 . . . . 71.31 110.866 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 188' ' ' PHE . . . . . 0.589 ' HD2' ' HB3' ' A' ' 108' ' ' LEU . 1.3 t80 -53.94 -33.72 57.59 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.172 -0.467 . . . . 75.45 110.914 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 189' ' ' LEU . . . . . 0.592 HD12 ' CD2' ' A' ' 224' ' ' PHE . 0.1 OUTLIER -67.1 -47.49 71.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.101 -0.499 . . . . 52.02 110.995 179.955 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.42 -42.54 74.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.16 -0.473 . . . . 74.22 110.927 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 191' ' ' ALA . . . . . 0.524 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -68.92 -35.28 76.63 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.125 -0.489 . . . . 50.03 111.124 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 192' ' ' ALA . . . . . 0.655 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -56.84 -43.08 80.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.256 -0.429 . . . . 52.11 111.071 179.886 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 193' ' ' THR . . . . . 0.788 HG21 HG21 ' A' ' 211' ' ' VAL . 0.2 OUTLIER -57.65 -41.45 81.47 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.208 -0.451 . . . . 72.43 111.113 -179.851 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 5.3 t-160 -73.34 -45.62 54.06 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.207 -0.451 . . . . 71.44 110.888 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -67.49 -48.91 65.74 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.157 -0.474 . . . . 71.01 111.057 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 196' ' ' LEU . . . . . 0.722 HD12 ' CD1' ' A' ' 113' ' ' LEU . 4.2 mm? -66.31 -37.36 85.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.293 -0.412 . . . . 74.51 110.924 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 197' ' ' GLY . . . . . 0.405 ' O ' ' HB3' ' A' ' 202' ' ' MET . . . -65.4 -28.49 73.64 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.744 -0.741 . . . . 52.23 112.461 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 198' ' ' HIS . . . . . 0.49 ' CD2' HG21 ' A' ' 69' ' ' VAL . 4.0 m-70 -66.87 -37.9 85.29 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.84 0.352 . . . . 75.21 110.873 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -64.46 -20.92 66.48 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.218 -0.446 . . . . 71.13 110.808 -179.764 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 200' ' ' LEU . . . . . 0.432 ' HA ' ' CD1' ' A' ' 84' ' ' TRP . 0.6 OUTLIER -88.5 0.63 56.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.216 -0.447 . . . . 64.13 110.854 -179.969 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 84.1 -6.34 75.88 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.807 -0.711 . . . . 50.41 112.452 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 202' ' ' MET . . . . . 0.406 ' HE1' ' HB ' ' A' ' 234' ' ' ILE . 36.5 tpp -50.27 139.27 15.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.877 0.37 . . . . 63.21 110.798 -180.0 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -103.26 158.98 17.3 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.751 -0.738 . . . . 64.44 112.438 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 27.3 m-70 -58.22 150.96 20.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.784 0.326 . . . . 74.32 110.881 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -116.39 146.87 42.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.261 -0.427 . . . . 53.34 110.814 -179.754 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 88.7 p -87.96 -4.74 58.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.106 -0.497 . . . . 72.22 110.889 -179.868 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.64 136.47 83.26 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.61 0.719 . . . . 65.11 110.849 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.75 -8.21 23.02 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.681 2.254 . . . . 74.53 112.417 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -122.92 23.02 9.5 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.16 -0.473 . . . . 63.52 110.948 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 210' ' ' ALA . . . . . 0.444 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.25 145.81 26.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.08 -0.509 . . . . 62.23 111.102 179.841 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 211' ' ' VAL . . . . . 0.788 HG21 HG21 ' A' ' 193' ' ' THR . 0.4 OUTLIER -69.55 -29.01 39.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.229 -0.441 . . . . 62.04 111.132 179.983 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -93.53 10.36 32.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.151 -0.477 . . . . 75.22 110.882 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 213' ' ' TYR . . . . . 0.407 ' HA ' ' HD2' ' A' ' 214' ' ' PRO . 2.3 t80 -55.56 114.68 7.74 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-O 121.699 0.761 . . . . 73.43 110.958 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 214' ' ' PRO . . . . . 0.407 ' HD2' ' HA ' ' A' ' 213' ' ' TYR . 53.5 Cg_endo -69.76 -20.0 35.41 Favored 'Trans proline' 0 C--O 1.232 0.211 0 C-N-CA 122.639 2.226 . . . . 63.01 112.315 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -86.45 49.18 1.75 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.255 -0.43 . . . . 74.24 111.128 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 6.5 t80 -61.69 124.13 19.87 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.251 -0.431 . . . . 74.14 110.937 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -157.27 -122.14 0.7 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.744 -0.741 . . . . 74.22 112.454 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -56.44 177.36 0.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.859 0.361 . . . . 64.22 110.905 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . 71.3 98.81 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.741 -0.742 . . . . 72.24 112.516 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 220' ' ' ASP . . . . . 0.417 ' HA ' ' HD2' ' A' ' 221' ' ' PRO . 0.3 OUTLIER -119.75 101.37 48.22 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-O 121.545 0.688 . . . . 41.43 110.878 -179.93 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 221' ' ' PRO . . . . . 0.417 ' HD2' ' HA ' ' A' ' 220' ' ' ASP . 53.2 Cg_endo -69.82 142.79 48.58 Favored 'Trans proline' 0 C--N 1.341 0.145 0 C-N-CA 122.646 2.231 . . . . 73.42 112.362 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -81.46 -22.83 37.83 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.191 -0.459 . . . . 74.21 110.848 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -125.57 -35.63 2.53 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.284 -0.416 . . . . 60.33 110.861 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 224' ' ' PHE . . . . . 0.592 ' CD2' HD12 ' A' ' 189' ' ' LEU . 0.0 OUTLIER 66.26 143.97 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.178 -0.465 . . . . 65.01 110.866 -179.998 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -143.19 163.01 34.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.165 -0.47 . . . . 64.24 110.941 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 226' ' ' LEU . . . . . 0.777 HD11 ' O ' ' A' ' 115' ' ' MET . 14.9 mt -61.77 148.99 41.23 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.276 -0.42 . . . . 53.44 110.968 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 227' ' ' SER . . . . . 0.444 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 0.3 OUTLIER -86.95 148.33 25.38 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.237 -0.438 . . . . 74.21 110.787 -179.836 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -60.5 -68.71 0.27 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.14 -0.482 . . . . 74.54 110.935 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.48 -25.42 36.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.217 -0.447 . . . . 72.22 110.828 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -68.89 -48.31 63.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.196 -0.456 . . . . 74.23 110.86 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 231' ' ' ILE . . . . . 0.678 HD11 ' HB3' ' A' ' 226' ' ' LEU . 8.0 mt -68.55 -42.67 83.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.236 -0.438 . . . . 73.41 111.096 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 14.0 ptmt -64.73 -32.38 74.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.242 -0.435 . . . . 65.42 110.889 179.826 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -62.9 -50.07 66.96 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.767 -0.73 . . . . 63.43 112.475 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 234' ' ' ILE . . . . . 0.406 ' HB ' ' HE1' ' A' ' 202' ' ' MET . 0.3 OUTLIER -73.15 -30.5 31.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.862 0.363 . . . . 71.54 111.195 179.98 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 15.3 mt-30 -67.13 -24.28 65.9 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.136 -0.483 . . . . 70.33 110.984 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 236' ' ' LYS . . . . . 0.418 ' HE2' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.09 -26.59 60.45 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.143 -0.481 . . . . 51.21 110.874 179.937 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 237' ' ' LEU . . . . . 0.663 ' O ' HD23 ' A' ' 237' ' ' LEU . 8.1 tt -97.63 -28.94 13.7 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.22 -0.445 . . . . 75.41 110.949 179.903 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 238' ' ' TYR . . . . . 0.538 ' CE1' HD11 ' A' ' 122' ' ' LEU . 21.4 m-85 -92.11 -35.15 14.05 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.19 -0.459 . . . . 51.24 110.958 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -136.59 -119.74 1.89 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.756 -0.735 . . . . 32.22 112.504 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.56 152.82 20.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.777 0.322 . . . . 75.42 110.866 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 1.3 ptm180 -96.78 -169.71 1.93 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.2 -0.454 . . . . 73.34 110.853 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -173.97 44.54 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.168 -0.469 . . . . 62.42 110.848 -179.796 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 17.1 t-20 63.32 82.14 0.19 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.118 -0.492 . . . . 72.13 110.934 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 22.3 p -173.4 140.46 0.83 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.243 -0.435 . . . . 62.23 110.897 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -178.59 175.98 1.05 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.161 -0.472 . . . . 70.43 110.863 -179.888 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.94 -174.9 0.82 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.187 -0.46 . . . . 72.11 110.884 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.229 -0.441 . . . . 74.13 110.877 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 302' ' ' ' CA' . . . . . 0.641 'CA ' ' O ' ' A' ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' -2' ' ' LEU . . . . . 0.401 HD13 ' HA ' ' A' ' -2' ' ' LEU . 4.4 mm? . . . . . 0 C--O 1.231 0.115 0 CA-C-O 121.539 0.685 . . . . 73.02 110.915 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' -1' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.7 112.42 3.06 Favored 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.677 2.252 . . . . 71.15 112.345 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 0' ' ' LEU . . . . . 0.49 ' N ' ' HD2' ' A' ' 1' ' ' PRO . 2.3 mm? -68.67 -60.48 4.57 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.589 0.709 . . . . 62.13 110.877 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.49 ' HD2' ' N ' ' A' ' 0' ' ' LEU . 54.5 Cg_endo -69.71 170.29 16.86 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.696 2.264 . . . . 64.14 112.388 179.826 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -116.34 131.56 56.91 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.236 -0.438 . . . . 60.51 110.89 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -95.48 -15.24 23.06 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.234 -0.439 . . . . 74.01 110.9 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.29 -33.89 65.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.169 -0.469 . . . . 71.4 111.18 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -55.83 -42.75 86.55 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.734 -0.746 . . . . 60.51 112.517 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -109.07 21.51 26.98 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.778 -0.725 . . . . 54.22 112.47 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -78.38 153.71 31.36 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.783 0.325 . . . . 72.23 110.925 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.1 m -97.3 168.71 10.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.249 -0.432 . . . . 73.24 110.812 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -54.23 -31.93 54.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.118 -0.492 . . . . 50.12 110.927 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 7.0 tp -62.04 -40.62 96.37 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.166 -0.47 . . . . 72.33 110.963 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -61.73 -45.06 95.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.124 -0.489 . . . . 72.14 110.917 179.935 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.545 ' CH2' HD23 ' A' ' 54' ' ' LEU . 40.5 t-105 -73.17 -33.8 65.66 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.227 -0.442 . . . . 71.22 110.92 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -67.61 -35.47 79.02 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.274 -0.421 . . . . 72.51 110.93 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 16.9 mm-40 -65.73 -36.72 84.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.108 -0.496 . . . . 61.24 110.905 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.461 ' O ' ' HE3' ' A' ' 62' ' ' MET . . . -57.28 -38.91 74.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.234 -0.439 . . . . 54.34 111.059 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.62 ' NE2' HD13 ' A' ' 35' ' ' LEU . 0.4 OUTLIER -72.7 -42.98 63.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.212 -0.449 . . . . 73.12 110.867 -179.955 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.527 ' O ' ' HG3' ' A' ' 20' ' ' LYS . 2.9 m-20 -67.06 -31.49 72.04 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.258 -0.428 . . . . 72.4 110.86 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.478 ' HA ' ' HG2' ' A' ' 21' ' ' ARG . 3.2 m-85 -72.07 -43.07 65.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.153 -0.476 . . . . 75.11 110.914 -179.809 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.48 HD13 ' C ' ' A' ' 19' ' ' LEU . 3.1 tm? -73.61 -33.78 64.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.471 . . . . 72.51 110.879 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.527 ' HG3' ' O ' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -73.06 -35.84 66.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.183 -0.462 . . . . 74.41 110.927 179.769 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.478 ' HG2' ' HA ' ' A' ' 18' ' ' TYR . 0.6 OUTLIER -71.5 -27.96 63.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.208 -0.451 . . . . 74.05 110.869 -179.956 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -60.08 -25.28 65.28 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.193 -0.458 . . . . 74.31 110.833 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -120.78 50.49 1.34 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.203 -0.453 . . . . 72.55 110.899 -179.854 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.0 mt 69.47 -162.14 0.17 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.144 -0.48 . . . . 75.43 110.911 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -80.88 89.56 5.86 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.181 -0.463 . . . . 71.41 110.984 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 54.8 m-20 -97.41 90.28 5.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.086 -0.506 . . . . 74.25 110.84 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 13.7 m -85.2 -25.16 27.54 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.129 -0.487 . . . . 62.15 110.874 -179.801 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.9 -15.41 61.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.206 -0.452 . . . . 74.51 110.886 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.493 HG23 ' HD2' ' A' ' 38' ' ' LYS . 2.4 m -78.38 -2.96 40.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.164 -0.471 . . . . 70.44 111.157 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.37 169.44 0.05 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.196 -0.456 . . . . 73.33 110.886 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 65.84 147.52 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.243 -0.435 . . . . 64.43 110.855 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.96 -26.55 59.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.14 -0.482 . . . . 70.21 111.062 179.885 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -51.91 -44.98 64.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.274 -0.421 . . . . 35.31 110.887 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -85.52 -22.86 27.96 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.259 -0.428 . . . . 74.02 110.897 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.62 HD13 ' NE2' ' A' ' 16' ' ' GLN . 5.1 tp -58.83 -39.77 82.24 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.121 -0.491 . . . . 72.52 110.96 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.3 -51.38 63.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.197 -0.456 . . . . 73.13 110.899 179.865 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.34 -38.91 92.99 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.2 -0.454 . . . . 63.32 111.186 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.493 ' HD2' HG23 ' A' ' 29' ' ' THR . 2.3 mmtt -69.34 -42.11 75.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.226 -0.443 . . . . 72.32 110.836 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.565 HD21 HD22 ' A' ' 54' ' ' LEU . 1.7 mp -54.48 -38.71 66.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.317 -0.401 . . . . 72.11 110.922 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -58.69 -45.42 89.51 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.171 -0.468 . . . . 62.43 110.905 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.451 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 1.5 pt-20 -60.67 -32.85 72.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.27 -0.423 . . . . 75.11 110.89 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 9.0 ttt -68.52 -34.1 75.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.113 -0.494 . . . . 63.43 110.884 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.654 ' CD ' HD11 ' A' ' 48' ' ' LEU . 2.5 mm100 -59.95 -39.42 85.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.209 -0.45 . . . . 74.45 110.935 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.9 mmpt? -71.57 -30.6 66.04 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.163 -0.472 . . . . 71.43 110.895 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -70.46 -43.5 69.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.225 -0.443 . . . . 73.32 110.875 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.843 ' CZ ' HD13 ' A' ' 61' ' ' ILE . 6.6 m-85 -82.01 -34.95 29.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.127 -0.488 . . . . 70.43 110.852 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.404 ' HA2' ' HB3' ' A' ' 206' ' ' SER . . . 103.07 -6.97 51.78 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.733 -0.746 . . . . 64.34 112.455 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.654 HD11 ' CD ' ' A' ' 43' ' ' GLN . 0.6 OUTLIER -59.85 137.28 90.4 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-O 121.657 0.741 . . . . 64.11 110.911 -179.893 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.69 -52.23 0.34 Allowed 'Trans proline' 0 C--N 1.343 0.239 0 C-N-CA 122.675 2.25 . . . . 74.5 112.32 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.599 HD12 HG23 ' A' ' 58' ' ' VAL . 0.9 OUTLIER -50.96 108.29 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.206 -0.452 . . . . 71.22 111.186 179.95 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.419 ' HA ' ' HG3' ' A' ' 43' ' ' GLN . 3.6 p -99.21 152.48 19.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.18 -0.464 . . . . 73.25 111.197 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 59.2 17.73 39.23 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.761 -0.733 . . . . 64.24 112.472 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 15.2 mmt -102.8 161.04 14.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.828 0.347 . . . . 75.23 110.848 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.565 HD22 HD21 ' A' ' 39' ' ' LEU . 29.5 tp -168.54 81.94 0.16 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.186 -0.461 . . . . 73.4 110.854 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.405 ' HA ' HG13 ' A' ' 59' ' ' ILE . 1.8 p30 174.5 -28.09 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.227 -0.442 . . . . 44.35 110.936 179.877 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.8 p -87.85 -99.86 0.08 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.121 -0.49 . . . . 75.25 110.843 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.664 ' O ' HG23 ' A' ' 61' ' ' ILE . 17.4 tpt180 -84.97 -29.16 25.3 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.108 -0.496 . . . . 61.22 110.904 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.599 HG23 HD12 ' A' ' 50' ' ' ILE . 84.7 t -60.95 -45.04 99.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.225 -0.443 . . . . 70.12 111.126 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.432 HD13 ' HA ' ' A' ' 59' ' ' ILE . 7.6 mm -75.37 -31.66 24.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.202 -0.454 . . . . 74.43 111.111 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.6 -44.1 93.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.196 -0.457 . . . . 73.45 110.886 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.843 HD13 ' CZ ' ' A' ' 46' ' ' PHE . 1.5 pp -66.82 -29.47 46.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.165 -0.47 . . . . 74.52 111.184 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.461 ' HE3' ' O ' ' A' ' 15' ' ' ALA . 8.2 mmt -63.0 -38.67 92.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.161 -0.472 . . . . 74.01 110.844 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -84.49 -25.71 28.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.254 -0.43 . . . . 42.22 110.934 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.42 136.24 37.79 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.547 0.689 . . . . 65.34 110.924 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -69.82 156.84 62.16 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.731 2.287 . . . . 72.11 112.28 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.464 ' HG3' ' HA ' ' A' ' 214' ' ' PRO . 13.1 ttp180 -149.88 -83.89 0.1 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.181 -0.463 . . . . 71.51 110.89 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -145.58 153.9 41.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.181 -0.463 . . . . 55.3 110.893 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.554 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -108.02 24.58 22.83 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.745 -0.74 . . . . 64.23 112.457 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.625 HG21 ' CD2' ' A' ' 198' ' ' HIS . 0.2 OUTLIER -106.69 134.38 19.85 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 121.629 0.728 . . . . 74.23 111.065 -179.947 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.48 ' HD2' HG12 ' A' ' 69' ' ' VAL . 53.9 Cg_endo -69.75 143.32 50.53 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.717 2.278 . . . . 63.44 112.289 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -102.08 24.52 9.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.233 -0.44 . . . . 74.45 110.878 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 3.9 m -142.13 129.92 20.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.221 -0.445 . . . . 53.43 111.13 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -130.9 170.18 14.78 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.153 -0.476 . . . . 73.13 111.126 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 177.2 166.54 0.58 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.225 -0.443 . . . . 73.31 110.863 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER 59.94 170.21 0.08 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.11 -0.496 . . . . 70.41 110.931 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 10.6 m 64.39 155.41 0.07 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.122 -0.49 . . . . 74.2 110.904 -179.801 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -104.3 96.87 6.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.16 -0.473 . . . . 70.34 110.912 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 4.7 p90 -50.57 157.01 1.36 Allowed Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.649 0.738 . . . . 71.24 110.889 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.444 ' HG3' ' HA2' ' A' ' 163' ' ' GLY . 53.5 Cg_endo -69.88 -175.5 1.21 Allowed 'Trans proline' 0 C--N 1.341 0.147 0 C-N-CA 122.68 2.254 . . . . 73.34 112.328 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -51.21 103.35 0.06 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.243 -0.435 . . . . 74.43 110.892 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 62.65 160.25 0.12 Allowed Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.717 0.77 . . . . 70.4 110.877 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.71 -50.59 0.46 Allowed 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.694 2.262 . . . . 71.11 112.367 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.679 ' HD2' HD22 ' A' ' 237' ' ' LEU . 4.4 mttp -78.82 165.85 23.09 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.217 -0.447 . . . . 64.45 110.91 179.873 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' TRP . . . . . 0.414 ' CD1' ' HA ' ' A' ' 200' ' ' LEU . 52.6 m95 -49.71 137.72 15.49 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.235 -0.439 . . . . 73.31 110.864 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 2.2 t -115.28 -27.14 7.35 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.207 -0.451 . . . . 65.3 111.112 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -53.19 171.41 0.07 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.215 -0.448 . . . . 70.34 110.808 -179.776 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.58 -30.69 20.33 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.133 -0.485 . . . . 71.12 110.905 179.916 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -148.39 140.43 18.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.214 -0.448 . . . . 74.14 111.108 179.888 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 90.4 t -123.35 141.39 43.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.155 -0.475 . . . . 72.25 111.106 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.758 HG22 ' HB3' ' A' ' 125' ' ' ARG . 15.2 p -115.61 155.16 28.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.188 -0.46 . . . . 71.01 111.202 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.437 ' O ' HG21 ' A' ' 127' ' ' VAL . 3.9 p90 -137.42 146.61 44.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.265 -0.425 . . . . 70.51 110.911 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.53 ' HB3' ' HB3' ' A' ' 132' ' ' ALA . 7.7 ttt-85 -150.87 139.09 20.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.123 -0.49 . . . . 71.25 110.9 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.543 HD11 ' HA ' ' A' ' 106' ' ' ASP . 10.3 mm -75.2 133.97 30.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.197 -0.456 . . . . 72.4 111.099 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.679 HG22 ' SD ' ' A' ' 135' ' ' MET . 8.1 t -91.32 -40.63 12.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.162 -0.472 . . . . 60.2 111.114 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -149.05 169.39 20.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.168 -0.469 . . . . 64.24 110.841 -179.818 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 14.8 p90 -132.29 155.01 49.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.161 -0.472 . . . . 72.25 110.925 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.5 t -102.38 141.78 34.66 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.169 -0.469 . . . . 64.11 111.101 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -52.5 -18.7 1.81 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.449 . . . . 72.14 110.863 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -65.08 -37.07 86.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.21 -0.45 . . . . 74.13 110.9 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.5 mp -142.47 152.11 59.46 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.65 0.738 . . . . 72.52 110.899 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' PRO . . . . . 0.572 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.9 Cg_endo -69.7 150.94 69.26 Favored 'Trans proline' 0 C--N 1.343 0.244 0 C-N-CA 122.637 2.225 . . . . 73.11 112.362 179.879 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -52.19 -27.84 16.1 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.19 -0.459 . . . . 74.11 110.828 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.572 HG22 ' HB2' ' A' ' 101' ' ' PRO . 2.2 tp -75.22 -38.91 42.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.212 -0.449 . . . . 74.02 111.173 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' THR . . . . . 0.775 ' O ' HD22 ' A' ' 108' ' ' LEU . 2.9 m -69.34 -36.84 77.32 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.144 -0.48 . . . . 52.11 111.183 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.762 ' O ' HG13 ' A' ' 109' ' ' VAL . 55.2 t -71.43 -43.44 72.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.159 -0.473 . . . . 71.51 111.105 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.616 ' O ' HG22 ' A' ' 109' ' ' VAL . 24.9 t0 -66.54 -37.57 85.29 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.123 -0.489 . . . . 63.44 110.881 179.878 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' ARG . . . . . 0.488 ' HG3' ' N ' ' A' ' 108' ' ' LEU . 0.0 OUTLIER -70.36 -33.38 71.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.248 -0.433 . . . . 75.02 110.829 -179.865 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.775 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -66.11 -48.97 69.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.229 -0.441 . . . . 71.04 110.849 -179.891 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.762 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.4 m -55.13 -43.27 69.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.228 -0.442 . . . . 72.31 111.108 179.82 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.494 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 48.2 t -70.7 -34.33 71.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.149 -0.478 . . . . 72.14 110.867 -179.814 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.451 ' CG ' HD21 ' A' ' 189' ' ' LEU . 0.3 OUTLIER -62.56 -33.34 74.74 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.136 -0.483 . . . . 74.35 110.948 179.92 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -95.39 -40.49 9.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.254 -0.43 . . . . 74.32 111.108 179.792 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.719 ' CD1' HD12 ' A' ' 196' ' ' LEU . 0.4 OUTLIER -65.54 -32.76 74.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.197 -0.456 . . . . 72.0 110.939 -179.999 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 42.4 t30 -65.48 -35.29 80.46 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.187 -0.46 . . . . 72.34 110.84 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' MET . . . . . 0.651 ' O ' HD11 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -68.31 -34.52 76.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.188 -0.46 . . . . 54.12 110.813 179.992 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 116' ' ' TRP . . . . . 0.412 ' CG ' HD11 ' A' ' 200' ' ' LEU . 6.0 m95 -66.99 -44.86 79.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.287 -0.415 . . . . 75.23 111.006 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -73.39 -40.74 47.56 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.73 -0.748 . . . . 73.32 112.45 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.431 ' HG2' ' O ' ' A' ' 115' ' ' MET . 3.8 ptpt -60.75 -18.43 54.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.811 0.338 . . . . 72.42 110.92 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.775 ' HG2' HD13 ' A' ' 226' ' ' LEU . 0.1 OUTLIER -96.87 13.46 28.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.167 -0.47 . . . . 75.24 110.884 179.934 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.917 HD12 HD12 ' A' ' 122' ' ' LEU . 3.6 pt -147.92 156.0 44.15 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.591 0.71 . . . . 71.34 111.15 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.77 0.27 5.9 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.675 2.25 . . . . 72.21 112.334 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.917 HD12 HD12 ' A' ' 120' ' ' ILE . 12.5 mt -61.18 -157.92 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.229 -0.441 . . . . 73.22 110.909 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.473 ' H ' ' HB3' ' A' ' 122' ' ' LEU . 28.1 t-80 -162.66 137.92 6.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.159 -0.473 . . . . 74.12 110.907 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 17.5 m-30 -122.27 142.35 50.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.199 -0.455 . . . . 75.54 110.889 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.758 ' HB3' HG22 ' A' ' 90' ' ' THR . 0.0 OUTLIER -115.26 140.96 48.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.125 -0.489 . . . . 75.14 110.897 -179.888 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.19 141.62 34.02 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.196 -0.456 . . . . 72.22 110.886 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 127' ' ' VAL . . . . . 0.874 HG11 ' HB2' ' A' ' 132' ' ' ALA . 34.4 m -103.0 139.49 23.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.259 -0.428 . . . . 50.13 111.183 179.8 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -155.13 -29.25 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.165 -0.47 . . . . 74.43 111.077 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -133.22 109.19 9.25 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.146 -0.479 . . . . 71.25 110.881 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.46 -160.69 13.94 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.764 -0.732 . . . . 62.11 112.559 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -101.99 155.77 17.96 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.783 0.325 . . . . 63.25 111.16 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 132' ' ' ALA . . . . . 0.874 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -112.14 165.41 12.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.193 -0.458 . . . . 51.34 111.068 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -69.5 -54.67 13.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.204 -0.453 . . . . 75.41 110.931 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 27.8 mt -83.8 132.57 31.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.138 -0.483 . . . . 70.51 111.111 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' MET . . . . . 0.679 ' SD ' HG22 ' A' ' 94' ' ' VAL . 28.3 mmt -108.81 116.93 32.93 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.158 -0.474 . . . . 72.43 110.932 179.829 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -106.13 88.39 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.251 -0.432 . . . . 70.04 111.124 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 137' ' ' GLY . . . . . 0.454 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -130.17 169.48 21.11 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.701 -0.762 . . . . 63.34 112.47 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 138' ' ' PHE . . . . . 0.491 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 36.5 m-85 -112.78 145.88 39.8 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.875 0.369 . . . . 74.01 110.874 -179.859 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.491 ' HB2' ' O ' ' A' ' 138' ' ' PHE . . . 173.72 166.44 0.18 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.156 -0.475 . . . . 71.21 111.135 179.899 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -104.8 172.96 6.51 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.259 -0.428 . . . . 62.21 110.847 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -54.02 -21.53 17.7 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.69 -0.766 . . . . 74.24 112.476 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -67.08 -12.07 58.9 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.812 0.339 . . . . 75.03 111.092 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 2.0 p80 -68.92 -11.6 60.79 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.252 -0.431 . . . . 71.11 110.855 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 117.68 36.57 0.97 Allowed Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.723 -0.751 . . . . 45.51 112.5 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -120.91 139.97 52.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.76 0.315 . . . . 72.14 110.937 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.23 161.76 18.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.451 . . . . 51.25 110.842 -179.7 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 11.9 m-85 64.71 133.52 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.649 0.738 . . . . 73.4 110.91 -179.864 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.79 134.81 28.82 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.621 2.214 . . . . 74.53 112.336 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -73.59 -33.1 64.45 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.207 -0.451 . . . . 63.52 110.851 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 74.57 -2.5 2.8 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.186 -0.461 . . . . 63.11 110.9 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 151' ' ' GLY . . . . . 0.676 ' O ' 'CA ' ' A' ' 302' ' ' ' CA' . . . 49.5 -108.72 0.49 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.706 -0.759 . . . . 71.41 112.531 -179.855 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.87 139.02 38.83 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.627 2.218 . . . . 75.11 112.325 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 103.21 -153.28 18.09 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.752 -0.737 . . . . 70.32 112.425 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -41.87 155.1 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.898 0.38 . . . . 73.25 110.894 -179.867 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 155' ' ' THR . . . . . 0.472 HG23 ' HA2' ' A' ' 68' ' ' GLY . 0.2 OUTLIER 75.31 108.78 0.07 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.132 -0.485 . . . . 44.41 111.158 -179.971 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 156' ' ' LEU . . . . . 1.053 HD21 HG21 ' A' ' 186' ' ' ILE . 0.5 OUTLIER -90.53 -53.67 4.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.177 -0.465 . . . . 75.02 110.866 -179.98 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 157' ' ' ALA . . . . . 0.587 ' HB1' ' O ' ' A' ' 171' ' ' HIS . . . -165.42 148.37 7.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.185 -0.461 . . . . 71.42 111.149 179.823 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 24.0 p-80 -106.13 126.53 52.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.245 -0.434 . . . . 72.02 110.84 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -110.91 160.9 16.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.155 -0.475 . . . . 74.42 111.061 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 13.6 m-85 -111.68 156.96 21.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.215 -0.448 . . . . 75.31 110.913 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 161' ' ' ALA . . . . . 0.69 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -87.79 164.09 35.62 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 121.586 0.708 . . . . 61.04 111.155 179.878 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 162' ' ' PRO . . . . . 0.69 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 54.5 Cg_endo -69.71 81.8 0.78 Allowed 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.755 2.304 . . . . 74.44 112.37 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 163' ' ' GLY . . . . . 0.444 ' HA2' ' HG3' ' A' ' 79' ' ' PRO . . . -146.7 128.8 3.11 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.727 -0.749 . . . . 61.41 112.448 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 63.9 -172.36 0.17 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.8 0.333 . . . . 73.1 111.174 -179.864 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -87.41 -41.51 6.49 Favored Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.736 -0.745 . . . . 74.03 112.409 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 166' ' ' LEU . . . . . 0.554 HD23 ' O ' ' A' ' 166' ' ' LEU . 8.8 tt -71.4 -32.78 68.82 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.84 0.352 . . . . 65.12 110.85 -179.811 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -79.35 172.45 55.11 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.665 -0.778 . . . . 43.43 112.467 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 78.03 23.08 67.13 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.679 -0.772 . . . . 74.31 112.479 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 95.2 m-20 -97.23 167.49 11.0 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.892 0.377 . . . . 63.41 110.837 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.91 130.34 56.15 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.151 -0.477 . . . . 74.21 111.096 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 171' ' ' HIS . . . . . 0.587 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 16.2 m170 -127.24 132.91 50.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.221 -0.445 . . . . 72.53 110.791 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 41.9 m-85 -116.86 139.59 50.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.171 -0.468 . . . . 71.44 110.904 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 65.4 t0 -69.38 97.18 0.95 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.151 -0.477 . . . . 74.11 110.861 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.97 -16.66 7.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.166 -0.47 . . . . 72.25 110.85 -179.858 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -79.48 -19.66 49.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.14 -0.482 . . . . 73.32 110.811 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -78.81 -174.87 4.17 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.237 -0.438 . . . . 63.2 110.932 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 177' ' ' ARG . . . . . 0.455 ' HG3' ' HA3' ' A' ' 185' ' ' GLY . 1.4 ptm180 -116.54 116.74 28.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.222 -0.444 . . . . 63.14 110.831 -179.874 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 178' ' ' TRP . . . . . 0.4 ' CE3' ' HB ' ' A' ' 186' ' ' ILE . 21.4 m95 -117.11 148.14 41.8 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.142 -0.481 . . . . 72.31 110.856 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 179' ' ' THR . . . . . 0.497 HG21 ' OG ' ' A' ' 182' ' ' SER . 7.5 t 179.16 163.65 0.87 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.206 -0.452 . . . . 74.13 111.167 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -128.35 -68.26 0.77 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.171 -0.468 . . . . 45.33 110.87 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -60.34 -15.16 37.14 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.672 -0.775 . . . . 62.41 112.536 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 182' ' ' SER . . . . . 0.497 ' OG ' HG21 ' A' ' 179' ' ' THR . 0.3 OUTLIER -97.51 -24.33 15.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.865 0.364 . . . . 64.5 110.862 -179.773 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 66.7 m 37.84 56.42 1.56 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.158 -0.474 . . . . 64.12 110.821 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 1.3 tp -116.9 -33.2 4.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.102 -0.499 . . . . 74.2 110.867 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 185' ' ' GLY . . . . . 0.455 ' HA3' ' HG3' ' A' ' 177' ' ' ARG . . . -114.37 -142.25 7.93 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.756 -0.735 . . . . 73.01 112.52 179.912 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 186' ' ' ILE . . . . . 1.053 HG21 HD21 ' A' ' 156' ' ' LEU . 11.1 mm -79.07 97.71 2.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.81 0.338 . . . . 73.22 111.125 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -45.53 117.21 1.36 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.199 -0.455 . . . . 71.31 110.815 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 188' ' ' PHE . . . . . 0.684 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.7 t80 -54.09 -36.91 63.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.106 -0.497 . . . . 75.45 110.868 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 189' ' ' LEU . . . . . 0.451 HD21 ' CG ' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -67.21 -47.33 71.2 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.135 -0.484 . . . . 52.02 110.886 -179.94 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -68.93 -41.43 78.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.177 -0.465 . . . . 74.22 110.953 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 191' ' ' ALA . . . . . 0.61 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -69.11 -35.19 76.16 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.138 -0.483 . . . . 50.03 111.062 179.873 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 192' ' ' ALA . . . . . 0.687 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -57.26 -44.05 83.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.225 -0.443 . . . . 52.11 111.034 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.08 -43.49 87.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.226 -0.443 . . . . 72.43 111.169 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 17.6 t-160 -73.12 -42.06 63.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.206 -0.452 . . . . 71.44 110.82 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -70.12 -47.53 61.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.206 -0.452 . . . . 71.01 111.114 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 196' ' ' LEU . . . . . 0.719 HD12 ' CD1' ' A' ' 113' ' ' LEU . 4.5 mm? -64.54 -37.94 89.3 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.192 -0.458 . . . . 74.51 110.901 -179.947 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -60.97 -27.29 66.82 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.757 -0.735 . . . . 52.23 112.501 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 198' ' ' HIS . . . . . 0.625 ' CD2' HG21 ' A' ' 69' ' ' VAL . 6.5 m-70 -67.98 -35.69 78.76 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.732 0.301 . . . . 75.21 110.799 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.96 -20.88 65.1 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.282 -0.417 . . . . 71.13 110.837 -179.764 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 200' ' ' LEU . . . . . 0.473 ' HB2' ' HG2' ' A' ' 202' ' ' MET . 0.5 OUTLIER -88.02 -0.04 56.53 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.175 -0.466 . . . . 64.13 110.926 -179.992 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 83.97 5.53 87.65 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.723 -0.751 . . . . 50.41 112.533 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 202' ' ' MET . . . . . 0.602 ' SD ' HD12 ' A' ' 234' ' ' ILE . 97.7 mmm -62.73 173.11 1.39 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.781 0.324 . . . . 63.21 110.907 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -137.16 169.19 24.08 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.779 -0.724 . . . . 64.44 112.535 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 20.5 m-70 -66.84 151.49 47.41 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.768 0.318 . . . . 74.32 110.857 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -118.99 146.06 45.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.222 -0.445 . . . . 53.34 110.835 -179.771 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 206' ' ' SER . . . . . 0.404 ' HB3' ' HA2' ' A' ' 47' ' ' GLY . 3.6 m -87.86 -4.19 58.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.104 -0.498 . . . . 72.22 110.899 -179.847 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 207' ' ' ASP . . . . . 0.419 ' O ' ' CD1' ' A' ' 213' ' ' TYR . 0.1 OUTLIER -71.33 142.87 87.36 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.571 0.701 . . . . 65.11 110.874 179.916 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.68 -29.96 23.43 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.658 2.238 . . . . 74.53 112.405 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 3.1 p-10 -105.57 25.36 10.85 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.214 -0.448 . . . . 63.52 110.845 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 210' ' ' ALA . . . . . 0.47 ' O ' ' HB2' ' A' ' 213' ' ' TYR . . . -87.31 146.3 25.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.22 -0.445 . . . . 62.23 111.096 179.814 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 211' ' ' VAL . . . . . 0.478 HG12 ' HG3' ' A' ' 212' ' ' MET . 0.4 OUTLIER -73.59 -26.61 22.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.187 -0.46 . . . . 62.04 111.145 179.974 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 212' ' ' MET . . . . . 0.478 ' HG3' HG12 ' A' ' 211' ' ' VAL . 0.0 OUTLIER -87.86 9.87 20.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.12 -0.491 . . . . 75.22 110.87 179.932 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 213' ' ' TYR . . . . . 0.47 ' HB2' ' O ' ' A' ' 210' ' ' ALA . 0.4 OUTLIER -54.93 120.16 27.01 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.676 0.751 . . . . 73.43 110.88 -179.851 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 214' ' ' PRO . . . . . 0.464 ' HA ' ' HG3' ' A' ' 66' ' ' ARG . 53.4 Cg_endo -69.75 -17.97 37.33 Favored 'Trans proline' 0 C--N 1.342 0.184 0 C-N-CA 122.604 2.203 . . . . 63.01 112.374 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -84.26 -2.4 56.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.18 -0.464 . . . . 74.24 111.2 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 1.5 t80 64.35 150.6 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.173 -0.467 . . . . 74.14 110.954 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -51.71 103.72 0.12 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.742 -0.742 . . . . 74.22 112.458 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -51.62 -59.42 4.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.876 0.37 . . . . 64.22 110.832 -179.868 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . -67.88 -175.07 8.5 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.742 -0.742 . . . . 72.24 112.491 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 220' ' ' ASP . . . . . . . . . . . . . 44.4 t0 -102.6 101.32 19.64 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.576 0.703 . . . . 41.43 110.833 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -69.72 114.36 3.67 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.683 2.255 . . . . 73.42 112.347 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -81.5 -38.6 26.04 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.237 -0.438 . . . . 74.21 110.937 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -121.81 -32.5 3.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.201 -0.454 . . . . 60.33 110.876 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER 65.65 135.36 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.155 -0.475 . . . . 65.01 110.915 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -143.8 160.55 40.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.455 . . . . 64.24 110.937 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 226' ' ' LEU . . . . . 0.775 HD13 ' HG2' ' A' ' 119' ' ' GLU . 6.6 mt -63.81 149.53 46.71 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.227 -0.442 . . . . 53.44 110.885 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 227' ' ' SER . . . . . . . . . . . . . 1.3 t -86.68 152.01 22.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.208 -0.451 . . . . 74.21 110.895 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 10.7 tt0 -64.4 -66.02 0.6 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.164 -0.471 . . . . 74.54 110.927 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 229' ' ' ASP . . . . . 0.439 ' O ' ' HG3' ' A' ' 232' ' ' LYS . 0.2 OUTLIER -56.08 -25.58 45.91 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.185 -0.462 . . . . 72.22 110.844 179.979 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 230' ' ' ASP . . . . . 0.401 ' OD2' HG12 ' A' ' 211' ' ' VAL . 0.5 OUTLIER -69.69 -48.7 58.74 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.205 -0.452 . . . . 74.23 110.855 -179.969 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 231' ' ' ILE . . . . . 0.67 HD11 ' HB3' ' A' ' 226' ' ' LEU . 9.2 mt -68.83 -41.58 82.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.152 -0.476 . . . . 73.41 111.12 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 232' ' ' LYS . . . . . 0.439 ' HG3' ' O ' ' A' ' 229' ' ' ASP . 0.0 OUTLIER -56.67 -32.06 65.03 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.167 -0.47 . . . . 65.42 110.89 179.855 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 233' ' ' GLY . . . . . 0.408 ' N ' ' HG3' ' A' ' 232' ' ' LYS . . . -64.95 -49.94 60.45 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.731 -0.747 . . . . 63.43 112.464 179.942 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 234' ' ' ILE . . . . . 0.602 HD12 ' SD ' ' A' ' 202' ' ' MET . 7.9 tt -72.84 -30.56 33.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.776 0.322 . . . . 71.54 111.173 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 13.0 mt-30 -69.72 -24.31 63.54 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.13 -0.486 . . . . 70.33 110.908 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 236' ' ' LYS . . . . . 0.449 ' HE2' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -73.81 -26.68 60.74 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.148 -0.478 . . . . 51.21 110.909 179.937 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 237' ' ' LEU . . . . . 0.679 HD22 ' HD2' ' A' ' 83' ' ' LYS . 10.3 tt -97.42 -36.17 10.44 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.223 -0.444 . . . . 75.41 110.931 179.911 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 238' ' ' TYR . . . . . 0.447 ' CE2' HD11 ' A' ' 122' ' ' LEU . 54.2 m-85 -92.12 -5.28 53.01 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.181 -0.463 . . . . 51.24 110.877 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -155.58 -117.04 0.56 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.778 -0.725 . . . . 32.22 112.435 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.03 149.59 31.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.709 0.29 . . . . 75.42 110.897 -179.917 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -89.47 -170.27 2.79 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.269 -0.423 . . . . 73.34 110.857 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 47.0 t -157.02 -41.89 0.07 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.227 -0.442 . . . . 62.42 110.902 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 15.0 p-10 -157.25 -174.21 4.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.124 -0.489 . . . . 72.13 110.95 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -92.55 160.72 14.91 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.241 -0.436 . . . . 62.23 110.871 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 7.4 ttp180 -163.87 142.25 7.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.15 -0.477 . . . . 70.43 110.872 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 1.7 tttt -87.62 149.13 24.49 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.189 -0.459 . . . . 72.11 110.85 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 4.8 tmtt? . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.228 -0.442 . . . . 74.13 110.838 179.863 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 302' ' ' ' CA' . . . . . 0.676 'CA ' ' O ' ' A' ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' -2' ' ' LEU . . . . . 0.54 ' H2 ' ' HD3' ' A' ' 57' ' ' ARG . 4.5 mm? . . . . . 0 C--O 1.231 0.129 0 CA-C-O 121.574 0.702 . . . . 73.02 110.878 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -1' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.85 78.62 1.03 Allowed 'Trans proline' 0 C--O 1.231 0.157 0 C-N-CA 122.671 2.247 . . . . 71.15 112.315 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 0' ' ' LEU . . . . . 0.494 ' N ' ' HD2' ' A' ' 1' ' ' PRO . 2.6 mm? -68.85 -60.5 4.4 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.584 0.707 . . . . 62.13 110.913 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.494 ' HD2' ' N ' ' A' ' 0' ' ' LEU . 54.2 Cg_endo -69.71 -176.56 1.51 Allowed 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.665 2.243 . . . . 64.14 112.355 179.845 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -178.81 39.78 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.217 -0.447 . . . . 60.51 110.923 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -77.13 -7.26 55.47 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.15 -0.477 . . . . 74.01 110.902 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.484 ' HB1' ' OD1' ' A' ' 55' ' ' ASN . . . -56.48 -34.07 66.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.169 -0.469 . . . . 71.4 111.059 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -63.2 -22.59 65.33 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.734 -0.746 . . . . 60.51 112.49 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -108.46 21.6 28.16 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.714 -0.755 . . . . 54.22 112.559 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 26.3 mtm -82.02 164.2 21.59 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.765 0.317 . . . . 72.23 110.821 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.7 m -97.38 168.73 10.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.25 -0.432 . . . . 73.24 110.861 -179.809 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.25 -33.19 57.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.109 -0.496 . . . . 50.12 110.916 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.35 -42.79 78.7 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.149 -0.478 . . . . 72.33 110.942 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.66 -37.97 76.91 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.178 -0.465 . . . . 72.14 110.909 179.924 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 30.8 t-105 -72.44 -41.2 66.4 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.17 -0.468 . . . . 71.22 110.895 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -68.49 -35.2 77.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.292 -0.413 . . . . 72.51 110.911 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -62.92 -36.52 83.65 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.151 -0.477 . . . . 61.24 110.949 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.502 ' CB ' HD11 ' A' ' 59' ' ' ILE . . . -57.01 -42.95 81.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.169 -0.469 . . . . 54.34 111.075 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 11.1 tt0 -70.45 -42.98 70.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.259 -0.428 . . . . 73.12 110.911 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -65.8 -31.53 72.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.141 -0.482 . . . . 72.4 110.88 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -62.26 -36.1 80.99 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.185 -0.461 . . . . 75.11 110.873 -179.789 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.712 HD21 ' HG3' ' A' ' 42' ' ' MET . 4.0 mt -70.43 -21.07 62.86 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.127 -0.488 . . . . 72.51 110.935 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.411 ' HG2' ' N ' ' A' ' 21' ' ' ARG . 4.6 ptmt -74.59 -31.21 61.97 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.216 -0.447 . . . . 74.41 110.909 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.411 ' N ' ' HG2' ' A' ' 20' ' ' LYS . 4.4 ptp180 -86.65 -27.45 23.78 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.227 -0.442 . . . . 74.05 110.89 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.414 ' O ' ' HA ' ' A' ' 70' ' ' PRO . 1.7 m-85 -60.78 -13.06 12.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 74.31 110.835 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -120.45 -65.95 1.1 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.131 -0.486 . . . . 72.55 110.959 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.404 ' HG ' HG21 ' A' ' 72' ' ' VAL . 25.3 mt -157.48 -78.39 0.08 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.167 -0.469 . . . . 75.43 110.866 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -176.9 89.9 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.218 -0.447 . . . . 71.41 110.881 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -99.86 90.41 4.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.137 -0.483 . . . . 74.25 110.907 179.85 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.1 -35.07 22.03 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.21 -0.45 . . . . 62.15 110.825 -179.773 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -80.8 -21.39 40.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.202 -0.454 . . . . 74.51 110.892 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 59.9 m -76.88 -18.16 58.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.17 -0.468 . . . . 70.44 111.102 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 4.9 tttt -56.31 100.26 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.269 -0.423 . . . . 73.33 110.853 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -166.31 160.38 15.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.191 -0.458 . . . . 64.43 110.877 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.31 -35.45 63.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.118 -0.492 . . . . 70.21 111.15 179.875 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -78.19 -45.86 22.01 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.165 -0.47 . . . . 35.31 110.867 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.61 -27.83 68.02 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.195 -0.457 . . . . 74.02 110.83 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.581 ' CD2' HD22 ' A' ' 39' ' ' LEU . 1.3 tt -57.89 -37.94 74.91 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.134 -0.485 . . . . 72.52 110.887 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.72 -48.37 74.9 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.191 -0.458 . . . . 73.13 110.92 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.28 -48.52 76.45 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.128 -0.487 . . . . 63.32 111.136 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.499 ' HE3' HD13 ' A' ' 19' ' ' LEU . 0.5 OUTLIER -67.9 -38.64 83.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.234 -0.439 . . . . 72.32 110.856 179.978 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.599 HD21 ' HB2' ' A' ' 54' ' ' LEU . 1.1 mp -54.58 -36.59 64.56 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.242 -0.435 . . . . 72.11 110.859 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.35 -45.68 87.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.173 -0.467 . . . . 62.43 110.907 179.836 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -69.7 -34.81 74.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.211 -0.45 . . . . 75.11 110.917 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.712 ' HG3' HD21 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -68.51 -47.04 68.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.107 -0.497 . . . . 63.43 110.909 179.912 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.55 ' CG ' HD11 ' A' ' 48' ' ' LEU . 3.2 mt-30 -58.57 -44.24 89.7 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.246 -0.434 . . . . 74.45 110.869 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.5 mmpt? -68.26 -29.99 68.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.175 -0.466 . . . . 71.43 110.904 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 30.0 t80 -69.98 -35.39 74.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.182 -0.463 . . . . 73.32 110.903 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.495 ' CB ' HD23 ' A' ' 48' ' ' LEU . 5.3 m-85 -79.57 -29.77 41.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.162 -0.472 . . . . 70.43 110.825 -179.891 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.45 ' HA2' ' HB2' ' A' ' 206' ' ' SER . . . 104.74 -10.56 49.1 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.694 -0.765 . . . . 64.34 112.536 -179.921 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.55 HD11 ' CG ' ' A' ' 43' ' ' GLN . 0.8 OUTLIER -67.27 139.34 94.8 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.683 0.754 . . . . 64.11 110.865 -179.86 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.71 -52.69 0.31 Allowed 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.705 2.27 . . . . 74.5 112.351 179.823 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.446 ' O ' HD12 ' A' ' 48' ' ' LEU . 0.6 OUTLIER -49.24 108.1 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.212 -0.449 . . . . 71.22 111.133 179.939 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 1.5 t -107.01 163.68 12.77 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.198 -0.456 . . . . 73.25 111.131 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 60.82 17.02 49.06 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.747 -0.74 . . . . 64.24 112.465 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -114.13 161.13 18.16 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.852 0.358 . . . . 75.23 110.899 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.599 ' HB2' HD21 ' A' ' 39' ' ' LEU . 55.5 tp -173.29 85.1 0.05 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.23 -0.441 . . . . 73.4 110.929 -179.928 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.484 ' OD1' ' HB1' ' A' ' 4' ' ' ALA . 2.6 m-20 172.44 -27.1 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.241 -0.436 . . . . 44.35 110.917 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 2.5 p -88.8 -97.14 0.09 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.224 -0.444 . . . . 75.25 110.875 -179.859 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.54 ' HD3' ' H2 ' ' A' ' -2' ' ' LEU . 9.6 tpt180 -85.04 -32.38 22.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.146 -0.479 . . . . 61.22 110.89 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 69.1 t -60.14 -45.47 95.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.225 -0.443 . . . . 70.12 111.166 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.502 HD11 ' CB ' ' A' ' 15' ' ' ALA . 0.8 OUTLIER -69.73 -31.32 48.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.168 -0.469 . . . . 74.43 111.113 179.881 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -59.36 -34.15 72.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.227 -0.442 . . . . 73.45 110.917 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.641 HG21 HG22 ' A' ' 215' ' ' THR . 0.2 OUTLIER -78.52 -30.03 15.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.108 -0.496 . . . . 74.52 111.121 179.977 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 5.2 mtt -63.11 -38.23 90.36 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.117 -0.492 . . . . 74.01 110.908 179.843 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -82.27 -23.14 35.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.147 -0.479 . . . . 42.22 110.927 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 27.5 mttm -85.34 140.77 36.5 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.638 0.732 . . . . 65.34 110.837 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.82 157.69 59.41 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.632 2.221 . . . . 72.11 112.361 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.413 ' HG3' ' HA ' ' A' ' 214' ' ' PRO . 34.5 ttp180 -155.18 -82.24 0.07 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.255 -0.429 . . . . 71.51 110.825 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -145.14 156.26 43.78 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.229 -0.441 . . . . 55.3 110.847 -179.862 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.637 ' HA2' HG23 ' A' ' 155' ' ' THR . . . -101.31 17.55 55.43 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.814 -0.708 . . . . 64.23 112.571 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.807 HG12 ' HD2' ' A' ' 70' ' ' PRO . 0.0 OUTLIER -109.19 143.49 27.79 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 121.732 0.777 . . . . 74.23 111.101 -179.95 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.807 ' HD2' HG12 ' A' ' 69' ' ' VAL . 53.2 Cg_endo -69.82 163.76 37.1 Favored 'Trans proline' 0 C--N 1.342 0.237 0 C-N-CA 122.713 2.275 . . . . 63.44 112.274 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 54.6 m-20 -112.53 33.79 4.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.152 -0.476 . . . . 74.45 110.822 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.404 HG21 ' HG ' ' A' ' 24' ' ' LEU . 1.8 m -137.55 129.42 40.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.224 -0.443 . . . . 53.43 111.229 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -131.02 170.71 14.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.174 -0.466 . . . . 73.13 111.058 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -138.49 173.07 11.98 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.165 -0.47 . . . . 73.31 110.824 -179.864 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -48.12 158.36 0.25 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.127 -0.488 . . . . 70.41 110.964 -179.815 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -50.96 122.11 7.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.222 -0.445 . . . . 74.2 110.885 -179.823 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.405 ' C ' ' CG ' ' A' ' 78' ' ' PHE . 2.2 mt -91.32 -24.62 19.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 70.34 110.811 -179.879 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' PHE . . . . . 0.676 ' H ' ' HD2' ' A' ' 79' ' ' PRO . 0.2 OUTLIER -153.59 -59.37 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.665 0.745 . . . . 71.24 110.877 179.954 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.676 ' HD2' ' H ' ' A' ' 78' ' ' PHE . 53.2 Cg_endo -69.83 175.48 8.1 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.672 2.248 . . . . 73.34 112.325 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 23.6 m120 -109.83 138.71 45.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.215 -0.448 . . . . 74.43 110.847 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 64.91 149.44 0.11 Allowed Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.681 0.753 . . . . 70.4 110.83 -179.852 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.72 -5.73 16.88 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.715 2.276 . . . . 71.11 112.382 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.723 ' CG ' HD22 ' A' ' 237' ' ' LEU . 0.2 OUTLIER -119.8 -168.07 1.54 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.226 -0.443 . . . . 64.45 110.903 179.918 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 58.1 m95 -76.14 140.01 41.56 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.205 -0.452 . . . . 73.31 110.887 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 11.4 t -114.67 -23.64 9.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.224 -0.443 . . . . 65.3 111.147 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -55.05 150.29 10.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.25 -0.432 . . . . 70.34 110.84 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 35.9 mmtt -64.86 -29.81 70.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.105 -0.498 . . . . 71.12 110.898 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -148.63 138.15 15.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 74.14 111.147 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 85.1 t -114.91 130.45 69.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.454 . . . . 72.25 111.118 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.682 HG22 ' HB3' ' A' ' 125' ' ' ARG . 28.6 p -115.91 168.09 10.37 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.155 -0.475 . . . . 71.01 111.125 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 4.2 p90 -146.48 146.78 30.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.163 -0.471 . . . . 70.51 110.888 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 4.4 ttt180 -149.0 138.11 21.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.113 -0.494 . . . . 71.25 110.884 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.409 HD11 ' HA ' ' A' ' 106' ' ' ASP . 10.3 mm -76.48 135.3 27.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.223 -0.444 . . . . 72.4 111.147 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.485 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 17.9 t -91.14 -40.36 12.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.184 -0.462 . . . . 60.2 111.143 179.819 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 25.9 p -142.22 169.49 17.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.127 -0.488 . . . . 64.24 110.855 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 5.2 p90 -115.14 150.74 35.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.124 -0.489 . . . . 72.25 110.889 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.545 ' OG1' HG21 ' A' ' 105' ' ' VAL . 0.2 OUTLIER -83.05 141.05 32.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.083 -0.508 . . . . 64.11 111.139 -179.996 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 3.7 mtt-85 -73.0 -8.28 55.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.215 -0.448 . . . . 72.14 110.908 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -96.53 -26.0 15.43 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.148 -0.478 . . . . 74.13 110.893 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.663 HD21 ' HA ' ' A' ' 179' ' ' THR . 0.8 OUTLIER -135.91 153.51 77.11 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.676 0.75 . . . . 72.52 110.882 -179.904 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 101' ' ' PRO . . . . . 0.608 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.5 Cg_endo -69.76 150.91 68.82 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.684 2.256 . . . . 73.11 112.309 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 6.4 t-160 -53.34 -25.55 15.62 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.102 -0.499 . . . . 74.11 110.852 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.608 HG22 ' HB2' ' A' ' 101' ' ' PRO . 13.2 tt -76.54 -38.37 31.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.239 -0.437 . . . . 74.02 111.13 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 104' ' ' THR . . . . . 0.624 ' O ' HD22 ' A' ' 108' ' ' LEU . 2.9 m -69.14 -40.59 78.15 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.193 -0.458 . . . . 52.11 111.161 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.735 ' O ' HG13 ' A' ' 109' ' ' VAL . 55.9 t -72.92 -46.06 53.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 71.51 111.146 179.869 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.653 ' O ' HG22 ' A' ' 109' ' ' VAL . 60.5 t0 -61.5 -44.9 96.24 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.142 -0.481 . . . . 63.44 110.94 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -70.03 -33.41 71.95 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.161 -0.472 . . . . 75.02 110.87 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.624 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -60.26 -49.27 78.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.451 . . . . 71.04 110.926 -179.94 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.735 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.5 m -55.3 -42.05 64.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.206 -0.452 . . . . 72.31 111.18 179.79 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.469 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 43.2 t -70.22 -33.45 71.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.138 -0.483 . . . . 72.14 110.804 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.458 ' HB3' HD21 ' A' ' 189' ' ' LEU . 0.8 OUTLIER -61.46 -33.05 73.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.15 -0.477 . . . . 74.35 110.853 -179.984 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.75 -40.15 9.11 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.262 -0.426 . . . . 74.32 111.135 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.799 HD12 HD12 ' A' ' 196' ' ' LEU . 0.3 OUTLIER -63.98 -33.63 76.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.216 -0.447 . . . . 72.0 110.891 -179.965 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -65.6 -35.65 81.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.205 -0.452 . . . . 72.34 110.925 179.882 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' MET . . . . . 0.725 ' HB3' HD23 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -66.3 -31.95 73.07 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.13 -0.487 . . . . 54.12 110.913 179.892 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 116' ' ' TRP . . . . . 0.538 ' CZ3' HD11 ' A' ' 226' ' ' LEU . 8.7 m95 -73.98 -45.22 51.45 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.27 -0.423 . . . . 75.23 110.861 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -66.05 -44.75 90.8 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.775 -0.726 . . . . 73.32 112.464 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.471 ' HG3' ' O ' ' A' ' 115' ' ' MET . 0.0 OUTLIER -61.97 -17.38 56.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.702 0.287 . . . . 72.42 110.865 -179.943 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.459 ' HG3' ' HG ' ' A' ' 226' ' ' LEU . 34.5 mm-40 -91.32 2.26 56.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.244 -0.435 . . . . 75.24 110.847 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 1.023 HD12 HD12 ' A' ' 122' ' ' LEU . 6.0 pt -139.29 150.61 64.9 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.659 0.743 . . . . 71.34 111.094 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 6.35 1.34 Allowed 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.699 2.266 . . . . 72.21 112.43 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 1.023 HD12 HD12 ' A' ' 120' ' ' ILE . 11.3 mt -60.96 -161.11 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.129 -0.487 . . . . 73.22 110.986 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 11.6 t-80 -151.03 122.48 7.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.24 -0.436 . . . . 74.12 110.858 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 10.6 m-30 -109.51 148.41 31.25 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.173 -0.467 . . . . 75.54 110.899 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.682 ' HB3' HG22 ' A' ' 90' ' ' THR . 0.0 OUTLIER -133.14 141.9 48.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.117 -0.492 . . . . 75.14 110.848 -179.907 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.8 147.58 30.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.152 -0.476 . . . . 72.22 110.934 -179.977 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 127' ' ' VAL . . . . . 1.02 HG11 ' HB2' ' A' ' 132' ' ' ALA . 30.1 m -103.25 126.29 57.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.26 -0.427 . . . . 50.13 111.162 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.598 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -142.52 -9.89 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.205 -0.452 . . . . 74.43 111.154 179.947 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 129' ' ' TRP . . . . . 0.598 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -155.75 109.08 2.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.116 -0.493 . . . . 71.25 110.87 -179.972 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.15 -159.96 14.38 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.748 -0.739 . . . . 62.11 112.502 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.8 156.21 17.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.842 0.354 . . . . 63.25 111.116 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 132' ' ' ALA . . . . . 1.02 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -111.83 165.1 12.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.191 -0.459 . . . . 51.34 111.081 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -67.66 -55.8 11.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.231 -0.441 . . . . 75.41 110.885 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 31.6 mt -92.4 133.04 35.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.223 -0.444 . . . . 70.51 111.167 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' MET . . . . . 0.485 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 14.7 mmm -111.23 124.48 52.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.226 -0.443 . . . . 72.43 110.875 179.821 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -107.06 91.22 1.7 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.147 -0.479 . . . . 70.04 111.107 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 137' ' ' GLY . . . . . 0.423 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -132.38 164.25 23.9 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.736 -0.745 . . . . 63.34 112.507 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 138' ' ' PHE . . . . . 0.469 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 46.2 m-85 -105.67 144.28 32.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.793 0.33 . . . . 74.01 110.86 -179.819 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.469 ' HB2' ' O ' ' A' ' 138' ' ' PHE . . . 175.15 167.03 0.3 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.143 -0.48 . . . . 71.21 111.033 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 20.8 mtm105 -104.36 173.62 6.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.192 -0.458 . . . . 62.21 110.88 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -56.06 -17.1 15.47 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.734 -0.746 . . . . 74.24 112.547 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -83.5 3.48 32.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.812 0.339 . . . . 75.03 111.118 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 7.2 p80 -69.85 -30.39 67.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.236 -0.438 . . . . 71.11 110.848 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 144.51 41.03 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.747 -0.74 . . . . 45.51 112.462 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 55.4 p-10 -146.64 162.22 38.91 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.839 0.352 . . . . 72.14 110.89 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 51.0 m -81.65 -179.9 7.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.151 -0.477 . . . . 51.25 110.888 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 64.65 123.68 0.02 OUTLIER Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.684 0.754 . . . . 73.4 110.937 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.83 146.19 58.98 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.717 2.278 . . . . 74.53 112.344 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 149' ' ' PHE . . . . . 0.411 ' CE1' ' HB2' ' A' ' 173' ' ' ASP . 0.1 OUTLIER -90.81 -33.19 15.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.21 -0.45 . . . . 63.52 110.882 -179.952 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 73.87 -1.76 2.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.111 -0.495 . . . . 63.11 110.847 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 151' ' ' GLY . . . . . 0.652 ' O ' 'CA ' ' A' ' 302' ' ' ' CA' . . . 51.88 -111.83 1.64 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.762 -0.732 . . . . 71.41 112.459 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.82 139.59 40.39 Favored 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.68 2.254 . . . . 75.11 112.333 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 103.14 -153.14 18.12 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.757 -0.735 . . . . 70.32 112.452 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 154' ' ' ASN . . . . . 0.415 ' O ' ' CB ' ' A' ' 155' ' ' THR . 1.4 p-10 -40.81 152.04 0.05 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.913 0.387 . . . . 73.25 110.891 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 155' ' ' THR . . . . . 0.637 HG23 ' HA2' ' A' ' 68' ' ' GLY . 1.4 m 78.34 110.81 0.07 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.189 -0.46 . . . . 44.41 111.112 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 156' ' ' LEU . . . . . 1.053 HD21 HG21 ' A' ' 186' ' ' ILE . 0.7 OUTLIER -92.25 -52.57 4.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.223 -0.444 . . . . 75.02 110.892 179.959 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 157' ' ' ALA . . . . . 0.556 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -166.81 148.12 6.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.246 -0.434 . . . . 71.42 111.087 179.811 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 24.6 p-80 -106.46 125.58 51.17 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.254 -0.43 . . . . 72.02 110.888 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -111.0 154.82 23.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 74.42 111.079 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 18.1 m-85 -104.21 150.09 24.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.183 -0.462 . . . . 75.31 110.842 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 161' ' ' ALA . . . . . 0.652 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -77.67 162.64 67.47 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 121.573 0.701 . . . . 61.04 111.122 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 162' ' ' PRO . . . . . 0.652 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 54.5 Cg_endo -69.68 77.51 1.04 Allowed 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.658 2.239 . . . . 74.44 112.369 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 163' ' ' GLY . . . . . 0.408 ' HA2' ' HB3' ' A' ' 79' ' ' PRO . . . -132.56 124.71 3.94 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.736 -0.745 . . . . 61.41 112.441 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 9.6 p 50.95 -170.72 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.856 0.36 . . . . 73.1 111.172 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -76.1 -57.51 4.0 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.775 -0.726 . . . . 74.03 112.479 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 166' ' ' LEU . . . . . 0.473 HD23 ' O ' ' A' ' 166' ' ' LEU . 7.7 tt -54.37 -39.69 67.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.853 0.358 . . . . 65.12 110.927 -179.886 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -81.01 153.63 34.43 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.693 -0.765 . . . . 43.43 112.446 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 95.12 23.02 21.19 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.747 -0.739 . . . . 74.31 112.537 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 82.4 m-20 -92.14 173.29 7.9 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.825 0.345 . . . . 63.41 110.88 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -118.2 130.63 56.2 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.166 -0.47 . . . . 74.21 111.114 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 171' ' ' HIS . . . . . 0.547 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 16.8 m170 -128.66 132.58 48.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.207 -0.451 . . . . 72.53 110.924 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -116.35 140.16 49.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.253 -0.431 . . . . 71.44 110.902 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 173' ' ' ASP . . . . . 0.411 ' HB2' ' CE1' ' A' ' 149' ' ' PHE . 68.0 t0 -69.22 96.85 0.87 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.117 -0.492 . . . . 74.11 110.778 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 2.6 pp20? -56.42 -17.95 9.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.222 -0.445 . . . . 72.25 110.886 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -79.55 -20.46 47.04 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.117 -0.492 . . . . 73.32 110.944 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 30.0 mm-40 -77.88 -172.4 2.66 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.16 -0.473 . . . . 63.2 110.926 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 177' ' ' ARG . . . . . 0.404 ' HG3' ' HA3' ' A' ' 185' ' ' GLY . 20.2 ptt180 -115.03 115.28 26.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.172 -0.467 . . . . 63.14 110.841 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 53.6 m95 -116.95 142.9 46.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.155 -0.475 . . . . 72.31 110.898 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 179' ' ' THR . . . . . 0.663 ' HA ' HD21 ' A' ' 100' ' ' LEU . 12.2 t -178.16 163.61 1.71 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.252 -0.431 . . . . 74.13 111.156 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -125.28 -68.9 0.82 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.209 -0.45 . . . . 45.33 110.896 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -63.99 -12.99 51.35 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.762 -0.732 . . . . 62.41 112.515 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 182' ' ' SER . . . . . 0.507 ' HB3' HG21 ' A' ' 179' ' ' THR . 0.4 OUTLIER -93.34 -24.41 18.12 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.852 0.358 . . . . 64.5 110.81 -179.712 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 86.9 p 38.27 42.96 0.56 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.185 -0.461 . . . . 64.12 110.839 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 2.3 tt -106.92 -33.42 7.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.126 -0.488 . . . . 74.2 110.913 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 185' ' ' GLY . . . . . 0.404 ' HA3' ' HG3' ' A' ' 177' ' ' ARG . . . -113.11 -145.46 9.38 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.69 -0.767 . . . . 73.01 112.428 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 186' ' ' ILE . . . . . 1.053 HG21 HD21 ' A' ' 156' ' ' LEU . 10.6 mm -78.93 97.77 2.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.875 0.369 . . . . 73.22 111.11 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -44.23 115.21 0.8 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.178 -0.464 . . . . 71.31 110.85 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 188' ' ' PHE . . . . . 0.552 ' HD2' ' HB3' ' A' ' 108' ' ' LEU . 1.4 t80 -53.88 -33.64 57.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.199 -0.455 . . . . 75.45 110.912 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 189' ' ' LEU . . . . . 0.574 HD12 ' HE2' ' A' ' 224' ' ' PHE . 0.2 OUTLIER -67.07 -48.25 68.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.098 -0.501 . . . . 52.02 110.922 -179.997 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.23 -39.77 74.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.151 -0.477 . . . . 74.22 110.938 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 191' ' ' ALA . . . . . 0.553 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -69.87 -34.9 74.18 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.171 -0.468 . . . . 50.03 111.047 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 192' ' ' ALA . . . . . 0.693 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -56.38 -44.61 80.36 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.247 -0.433 . . . . 52.11 111.1 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.77 -43.62 90.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 72.43 111.182 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 15.7 t-160 -72.9 -38.0 67.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.218 -0.446 . . . . 71.44 110.872 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -74.63 -47.38 32.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.201 -0.454 . . . . 71.01 111.117 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 196' ' ' LEU . . . . . 0.799 HD12 HD12 ' A' ' 113' ' ' LEU . 4.6 mm? -63.08 -45.78 90.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.259 -0.428 . . . . 74.51 110.906 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -54.86 -29.47 50.67 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.731 -0.747 . . . . 52.23 112.506 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 198' ' ' HIS . . . . . 0.461 ' CD2' HG21 ' A' ' 69' ' ' VAL . 6.4 m-70 -66.6 -35.89 81.28 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.887 0.375 . . . . 75.21 110.889 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 13.0 t -68.05 -21.28 65.01 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.171 -0.468 . . . . 71.13 110.877 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -89.55 -7.45 54.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.141 -0.481 . . . . 64.13 110.881 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 89.73 9.58 66.12 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.715 -0.755 . . . . 50.41 112.459 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 202' ' ' MET . . . . . . . . . . . . . 18.1 tpp -72.85 135.08 45.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.797 0.332 . . . . 63.21 110.92 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -101.34 159.11 18.71 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.799 -0.715 . . . . 64.44 112.453 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 11.2 m170 -54.77 163.04 1.04 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.736 0.303 . . . . 74.32 110.895 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -124.39 153.93 41.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.255 -0.429 . . . . 53.34 110.912 -179.878 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 206' ' ' SER . . . . . 0.45 ' HB2' ' HA2' ' A' ' 47' ' ' GLY . 7.9 p -88.2 -4.68 58.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.09 -0.504 . . . . 72.22 110.87 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.55 137.51 83.39 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.535 0.683 . . . . 65.11 110.882 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.74 -7.38 20.9 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.628 2.218 . . . . 74.53 112.383 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -125.48 29.32 6.04 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.132 -0.485 . . . . 63.52 110.867 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 210' ' ' ALA . . . . . 0.478 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.24 145.38 26.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.183 -0.462 . . . . 62.23 111.14 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -73.47 -25.14 20.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.218 -0.446 . . . . 62.04 111.143 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 35.3 mmm -95.24 9.52 39.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.451 . . . . 75.22 110.826 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 213' ' ' TYR . . . . . 0.434 ' HB2' ' O ' ' A' ' 210' ' ' ALA . 0.2 OUTLIER -55.59 126.7 64.65 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-O 121.633 0.73 . . . . 73.43 110.926 -179.895 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 214' ' ' PRO . . . . . 0.427 ' HD2' ' CD1' ' A' ' 213' ' ' TYR . 54.1 Cg_endo -69.69 -18.54 37.3 Favored 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.69 2.26 . . . . 63.01 112.313 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 215' ' ' THR . . . . . 0.641 HG22 HG21 ' A' ' 61' ' ' ILE . 18.6 p -99.85 66.97 1.42 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.213 -0.449 . . . . 74.24 111.052 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -41.2 122.66 1.87 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.222 -0.445 . . . . 74.14 110.877 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -77.71 172.39 55.16 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.745 -0.74 . . . . 74.22 112.51 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 12.4 t-20 -105.45 -22.35 13.03 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.864 0.364 . . . . 64.22 110.929 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . -51.58 155.35 3.96 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.728 -0.748 . . . . 72.24 112.52 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 220' ' ' ASP . . . . . 0.414 ' HA ' ' HD2' ' A' ' 221' ' ' PRO . 1.1 p-10 -119.86 101.23 48.09 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 121.605 0.717 . . . . 41.43 110.976 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 221' ' ' PRO . . . . . 0.414 ' HD2' ' HA ' ' A' ' 220' ' ' ASP . 53.9 Cg_endo -69.74 168.69 20.8 Favored 'Trans proline' 0 C--O 1.231 0.148 0 C-N-CA 122.691 2.261 . . . . 73.42 112.352 -179.921 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -75.49 -45.69 36.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.24 -0.437 . . . . 74.21 110.884 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -130.84 -40.83 1.18 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.214 -0.448 . . . . 60.33 110.859 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 224' ' ' PHE . . . . . 0.574 ' HE2' HD12 ' A' ' 189' ' ' LEU . 0.0 OUTLIER 63.93 126.99 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.157 -0.474 . . . . 65.01 110.855 -179.985 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.7 -170.8 3.39 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.124 -0.489 . . . . 64.24 110.931 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 226' ' ' LEU . . . . . 0.725 HD23 ' HB3' ' A' ' 115' ' ' MET . 0.9 OUTLIER -59.18 148.93 29.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.258 -0.428 . . . . 53.44 110.922 179.885 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 227' ' ' SER . . . . . 0.478 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 1.9 t -86.73 156.31 20.0 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.14 -0.482 . . . . 74.21 110.889 -179.936 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.71 -63.5 1.24 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.178 -0.464 . . . . 74.54 110.948 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 49.3 t0 -55.66 -27.47 50.16 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.233 -0.44 . . . . 72.22 110.878 179.861 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.77 -48.24 59.98 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.196 -0.456 . . . . 74.23 110.841 -179.977 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 231' ' ' ILE . . . . . 0.528 HD11 ' HB3' ' A' ' 226' ' ' LEU . 12.8 mt -68.32 -43.82 84.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.237 -0.438 . . . . 73.41 111.203 179.924 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.71 -32.45 73.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.074 -0.512 . . . . 65.42 110.867 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -62.78 -49.8 69.59 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.795 -0.717 . . . . 63.43 112.513 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 234' ' ' ILE . . . . . 0.529 ' CD1' HG21 ' A' ' 120' ' ' ILE . 18.9 tt -73.13 -32.27 38.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-O 120.803 0.335 . . . . 71.54 111.161 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -67.15 -29.19 68.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.112 -0.495 . . . . 70.33 110.86 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 236' ' ' LYS . . . . . 0.45 ' HE3' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.49 -24.21 58.98 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.2 -0.455 . . . . 51.21 110.903 179.935 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 237' ' ' LEU . . . . . 0.723 HD22 ' CG ' ' A' ' 83' ' ' LYS . 1.7 tt -97.58 -29.48 13.42 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.241 -0.436 . . . . 75.41 110.949 179.906 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 238' ' ' TYR . . . . . 0.463 ' OH ' HD11 ' A' ' 122' ' ' LEU . 3.9 m-85 -91.91 -35.72 13.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.175 -0.466 . . . . 51.24 110.851 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -139.69 -119.4 1.65 Allowed Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.786 -0.721 . . . . 32.22 112.435 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 2.4 pttm -90.42 153.68 20.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.807 0.337 . . . . 75.42 110.872 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 9.8 ptt-85 -90.79 -172.35 3.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.213 -0.449 . . . . 73.34 110.849 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 4.1 t -151.85 -66.26 0.17 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.203 -0.453 . . . . 62.42 110.906 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 13.8 t30 -178.4 90.2 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.155 -0.475 . . . . 72.13 110.896 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 1.2 p -177.12 160.46 1.76 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.152 -0.476 . . . . 62.23 110.854 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 4.0 mmm-85 -118.05 107.99 14.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.098 -0.501 . . . . 70.43 110.871 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -52.93 147.88 8.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.191 -0.458 . . . . 72.11 110.833 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 2.7 mtmt . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.176 -0.465 . . . . 74.13 110.952 179.798 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 302' ' ' ' CA' . . . . . 0.652 'CA ' ' O ' ' A' ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' -2' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.232 0.153 0 CA-C-O 121.598 0.713 . . . . 73.02 110.925 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' -1' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.91 114.7 3.81 Favored 'Trans proline' 0 C--O 1.232 0.199 0 C-N-CA 122.662 2.241 . . . . 71.15 112.308 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 37.1 mt -142.47 71.06 21.34 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-O 121.631 0.729 . . . . 62.13 110.973 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.79 -48.37 0.73 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.71 2.273 . . . . 64.14 112.334 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -176.09 97.3 0.06 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.178 -0.464 . . . . 60.51 110.884 -179.957 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -95.44 -28.39 14.94 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.199 -0.455 . . . . 74.01 110.9 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.505 ' HB2' ' CB ' ' A' ' 55' ' ' ASN . . . -56.66 -34.1 67.01 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.13 -0.486 . . . . 71.4 111.122 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -55.97 -23.44 38.7 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.674 -0.774 . . . . 60.51 112.506 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -108.2 20.1 31.18 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.744 -0.741 . . . . 54.22 112.468 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 26.3 mmt -102.11 164.23 11.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.741 0.305 . . . . 72.23 110.906 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -113.61 168.8 9.46 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.23 -0.441 . . . . 73.24 110.862 -179.765 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 24.6 pt-20 -54.4 -31.99 56.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.161 -0.472 . . . . 50.12 110.876 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.64 -42.75 99.78 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.195 -0.457 . . . . 72.33 110.885 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -62.42 -42.97 99.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.188 -0.46 . . . . 72.14 110.864 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.447 ' CE2' HD23 ' A' ' 54' ' ' LEU . 15.8 t-105 -73.09 -33.22 65.48 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.201 -0.454 . . . . 71.22 110.926 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -73.17 -36.49 66.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.229 -0.442 . . . . 72.51 110.947 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -63.77 -36.78 85.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.106 -0.497 . . . . 61.24 110.922 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.657 ' HB1' ' HE3' ' A' ' 62' ' ' MET . . . -63.6 -37.33 86.91 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.139 -0.482 . . . . 54.34 111.124 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.672 ' CD ' HD12 ' A' ' 35' ' ' LEU . 0.1 OUTLIER -67.65 -43.02 81.27 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.238 -0.437 . . . . 73.12 110.861 -179.925 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -73.94 -32.42 63.49 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.201 -0.454 . . . . 72.4 110.891 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 3.5 m-30 -70.65 -36.28 73.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.134 -0.485 . . . . 75.11 110.906 -179.795 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.679 HD13 HD22 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -71.7 -21.02 61.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.118 -0.492 . . . . 72.51 110.9 179.919 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 5.2 ptmt -74.77 -32.99 62.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.248 -0.433 . . . . 74.41 110.899 179.868 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.23 -26.4 33.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.244 -0.435 . . . . 74.05 110.852 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -65.3 -7.64 14.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.217 -0.447 . . . . 74.31 110.934 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.43 ' O ' HG23 ' A' ' 72' ' ' VAL . 8.9 m-85 -113.85 -76.29 0.58 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.097 -0.501 . . . . 72.55 110.94 -179.865 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.693 ' HG ' HG23 ' A' ' 72' ' ' VAL . 21.2 mt -160.45 29.82 0.16 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.1 -0.5 . . . . 75.43 110.938 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 5.6 t80 50.15 88.94 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.454 . . . . 71.41 110.908 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -125.9 124.95 41.98 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.089 -0.505 . . . . 74.25 110.867 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -84.99 -6.37 59.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.208 -0.451 . . . . 62.15 110.909 -179.818 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -74.4 -11.02 60.13 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.182 -0.463 . . . . 74.51 110.915 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 4.7 m -76.57 -2.29 31.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.152 -0.476 . . . . 70.44 111.122 -179.875 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.58 170.31 0.05 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.212 -0.449 . . . . 73.33 110.888 179.982 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 31.2 t-20 67.61 148.05 0.05 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.271 -0.422 . . . . 64.43 110.872 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.94 -26.35 59.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.145 -0.479 . . . . 70.21 111.109 179.882 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -51.96 -45.72 64.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.188 -0.46 . . . . 35.31 110.884 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -85.78 -19.84 30.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.188 -0.46 . . . . 74.02 110.832 -179.81 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.672 HD12 ' CD ' ' A' ' 16' ' ' GLN . 5.9 tt -61.51 -44.72 96.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.145 -0.48 . . . . 72.52 110.87 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -61.38 -48.78 79.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.242 -0.435 . . . . 73.13 110.893 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.79 -51.2 60.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.148 -0.478 . . . . 63.32 111.079 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.473 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.5 OUTLIER -59.78 -49.68 76.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.239 -0.437 . . . . 72.32 110.867 179.976 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.679 HD22 HD13 ' A' ' 19' ' ' LEU . 0.1 OUTLIER -55.34 -37.51 67.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.267 -0.424 . . . . 72.11 110.952 179.884 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.51 -45.58 88.47 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.219 -0.446 . . . . 62.43 110.844 179.798 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.473 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 2.2 pt-20 -60.56 -32.7 71.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.288 -0.414 . . . . 75.11 110.902 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -68.35 -34.32 75.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.032 -0.531 . . . . 63.43 110.865 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.574 ' OE1' HD11 ' A' ' 48' ' ' LEU . 4.9 mm-40 -58.35 -39.64 80.08 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.275 -0.42 . . . . 74.45 110.895 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.4 mmpt? -66.42 -28.73 68.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.22 -0.445 . . . . 71.43 110.935 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -70.49 -40.92 73.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.19 -0.459 . . . . 73.32 110.932 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.473 ' CB ' HD23 ' A' ' 48' ' ' LEU . 14.8 m-85 -82.03 -35.53 28.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.126 -0.488 . . . . 70.43 110.881 -179.97 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.411 ' HA3' ' HB2' ' A' ' 206' ' ' SER . . . 101.99 -8.99 56.33 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.711 -0.756 . . . . 64.34 112.518 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.574 HD11 ' OE1' ' A' ' 43' ' ' GLN . 0.7 OUTLIER -59.97 139.92 90.52 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.622 0.725 . . . . 64.11 110.922 -179.89 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.511 ' O ' HG23 ' A' ' 51' ' ' THR . 54.0 Cg_endo -69.74 -52.49 0.32 Allowed 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.651 2.234 . . . . 74.5 112.353 179.84 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.543 HD12 HG23 ' A' ' 58' ' ' VAL . 0.8 OUTLIER -52.15 108.06 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.271 -0.422 . . . . 71.22 111.167 179.868 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.511 HG23 ' O ' ' A' ' 49' ' ' PRO . 66.2 p -105.34 156.35 18.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.206 -0.452 . . . . 73.25 111.173 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 58.67 18.21 37.44 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.795 -0.716 . . . . 64.24 112.473 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -113.17 161.1 17.54 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.767 0.318 . . . . 75.23 110.887 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.447 HD23 ' CE2' ' A' ' 12' ' ' TRP . 25.8 tp -164.78 93.98 0.66 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.223 -0.444 . . . . 73.4 110.936 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.505 ' CB ' ' HB2' ' A' ' 4' ' ' ALA . 0.4 OUTLIER 178.18 -30.91 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.157 -0.474 . . . . 44.35 110.855 179.972 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 29.7 t -89.65 -102.24 0.09 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.175 -0.466 . . . . 75.25 110.919 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 65.9 mtt-85 -84.81 -27.13 27.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.184 -0.462 . . . . 61.22 110.953 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.543 HG23 HD12 ' A' ' 50' ' ' ILE . 84.2 t -65.62 -40.77 88.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.09 -0.504 . . . . 70.12 111.125 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -76.85 -31.43 19.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.214 -0.448 . . . . 74.43 111.145 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -65.02 -44.99 87.33 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.164 -0.471 . . . . 73.45 110.836 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.573 ' CG2' HG23 ' A' ' 215' ' ' THR . 14.9 pt -59.76 -29.63 43.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.163 -0.472 . . . . 74.52 111.148 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.657 ' HE3' ' HB1' ' A' ' 15' ' ' ALA . 9.7 mmm -60.64 -39.19 87.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.17 -0.468 . . . . 74.01 110.821 179.857 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -93.81 -25.64 17.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.265 -0.425 . . . . 42.22 110.905 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.69 118.35 71.53 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.605 0.717 . . . . 65.34 110.868 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.76 126.29 13.14 Favored 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.683 2.255 . . . . 72.11 112.371 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -121.29 -74.99 0.6 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.169 -0.469 . . . . 71.51 110.862 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 2.8 p -140.72 148.2 40.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.149 -0.478 . . . . 55.3 110.855 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.787 ' CA ' HG23 ' A' ' 155' ' ' THR . . . -93.9 13.88 66.48 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.701 -0.761 . . . . 64.23 112.495 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.632 HG12 ' HD2' ' A' ' 70' ' ' PRO . 0.1 OUTLIER -101.75 137.49 19.57 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.67 0.748 . . . . 74.23 111.073 -179.995 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.632 ' HD2' HG12 ' A' ' 69' ' ' VAL . 53.3 Cg_endo -69.83 159.12 54.53 Favored 'Trans proline' 0 C--O 1.231 0.153 0 C-N-CA 122.677 2.251 . . . . 63.44 112.33 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -94.53 4.91 53.24 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.198 -0.456 . . . . 74.45 110.813 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.693 HG23 ' HG ' ' A' ' 24' ' ' LEU . 0.1 OUTLIER -140.83 129.82 25.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.272 -0.422 . . . . 53.43 111.126 -179.983 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -130.98 170.42 14.5 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.122 -0.49 . . . . 73.13 111.138 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -158.03 120.07 3.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.27 -0.423 . . . . 73.31 110.861 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -170.42 94.38 0.22 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.113 -0.494 . . . . 70.41 110.933 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -55.95 177.21 0.06 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.173 -0.467 . . . . 74.2 110.8 -179.814 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 51.32 33.44 9.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.125 -0.489 . . . . 70.34 110.912 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 33.1 p90 -51.55 153.22 4.07 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.665 0.745 . . . . 71.24 110.85 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.407 ' HG3' ' HA2' ' A' ' 163' ' ' GLY . 53.2 Cg_endo -69.78 -175.13 1.06 Allowed 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.689 2.259 . . . . 73.34 112.343 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.545 ' HB2' HG21 ' A' ' 85' ' ' THR . 65.3 m-20 -64.27 97.43 0.19 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 74.43 110.851 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 63.57 157.51 0.12 Allowed Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.713 0.768 . . . . 70.4 110.781 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.75 -49.45 0.56 Allowed 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.702 2.268 . . . . 71.11 112.316 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.695 ' CE ' HD13 ' A' ' 237' ' ' LEU . 5.1 mttp -74.05 164.98 25.94 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.257 -0.428 . . . . 64.45 110.914 179.92 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' TRP . . . . . 0.499 ' CD1' ' HA ' ' A' ' 200' ' ' LEU . 19.6 m95 -52.86 132.5 37.05 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.248 -0.433 . . . . 73.31 110.87 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.545 HG21 ' HB2' ' A' ' 80' ' ' ASN . 5.6 t -115.08 -15.0 11.77 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.19 -0.459 . . . . 65.3 111.084 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -62.48 165.0 6.65 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.302 -0.408 . . . . 70.34 110.893 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.22 -30.26 38.59 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.165 -0.47 . . . . 71.12 110.909 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 1.1 p -148.12 137.84 16.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.214 -0.448 . . . . 74.14 111.174 179.86 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 97.2 t -119.1 138.66 49.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.158 -0.474 . . . . 72.25 111.141 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.684 HG22 ' HB3' ' A' ' 125' ' ' ARG . 7.5 p -115.87 168.07 10.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.157 -0.474 . . . . 71.01 111.088 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 6.5 p90 -147.08 147.08 30.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.15 -0.477 . . . . 70.51 110.979 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -146.85 136.39 22.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.136 -0.484 . . . . 71.25 110.847 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.639 ' CD1' HG11 ' A' ' 109' ' ' VAL . 16.4 mm -76.05 135.26 27.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.121 -0.49 . . . . 72.4 111.144 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.504 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 21.2 t -88.15 -40.68 13.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.191 -0.459 . . . . 60.2 111.128 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 4.3 t -153.74 158.88 41.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.178 -0.465 . . . . 64.24 110.951 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 10.5 p90 -106.1 147.71 28.64 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.248 -0.433 . . . . 72.25 110.902 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.539 ' O ' ' O ' ' A' ' 100' ' ' LEU . 0.3 OUTLIER -81.71 140.76 34.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.137 -0.483 . . . . 64.11 111.183 179.961 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -62.18 -15.98 49.95 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.244 -0.434 . . . . 72.14 110.834 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -91.16 -25.33 19.62 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.225 -0.443 . . . . 74.13 110.902 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.745 HD21 ' H ' ' A' ' 180' ' ' ASP . 18.4 mt -131.69 140.02 37.02 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.515 0.674 . . . . 72.52 110.928 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' PRO . . . . . 0.604 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.3 Cg_endo -69.8 150.87 68.53 Favored 'Trans proline' 0 C--O 1.232 0.218 0 C-N-CA 122.653 2.235 . . . . 73.11 112.309 179.872 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 3.1 t-160 -49.27 -29.99 6.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.226 -0.443 . . . . 74.11 110.823 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.604 HG22 ' HB2' ' A' ' 101' ' ' PRO . 16.6 tt -72.7 -43.16 61.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.214 -0.448 . . . . 74.02 111.136 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' THR . . . . . 0.599 HG21 HD22 ' A' ' 100' ' ' LEU . 2.3 m -69.63 -38.13 77.06 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.132 -0.485 . . . . 52.11 111.118 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.755 HG13 ' CZ ' ' A' ' 188' ' ' PHE . 75.5 t -72.87 -44.61 57.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.226 -0.443 . . . . 71.51 111.096 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.666 ' O ' HG22 ' A' ' 109' ' ' VAL . 29.7 t70 -62.95 -43.22 99.39 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.216 -0.447 . . . . 63.44 110.87 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -70.13 -33.25 71.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.205 -0.452 . . . . 75.02 110.846 -179.839 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.586 HD23 ' HB3' ' A' ' 188' ' ' PHE . 0.0 OUTLIER -60.18 -47.59 85.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.164 -0.471 . . . . 71.04 110.9 -179.957 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.666 HG22 ' O ' ' A' ' 106' ' ' ASP . 1.4 m -55.2 -41.46 60.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.161 -0.472 . . . . 72.31 111.171 179.843 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.477 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 42.5 t -70.56 -33.64 71.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.169 -0.469 . . . . 72.14 110.858 -179.857 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.589 ' HB3' HD21 ' A' ' 189' ' ' LEU . 0.5 OUTLIER -61.59 -33.1 73.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.099 -0.5 . . . . 74.35 110.879 179.943 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.56 -40.28 9.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.193 -0.458 . . . . 74.32 111.066 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.835 HD12 HD12 ' A' ' 196' ' ' LEU . 0.3 OUTLIER -65.59 -33.62 76.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.181 -0.463 . . . . 72.0 110.913 -179.95 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 44.2 t30 -69.64 -38.23 77.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.181 -0.463 . . . . 72.34 110.899 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' MET . . . . . 0.573 ' HB3' HD23 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -60.42 -34.23 73.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.138 -0.483 . . . . 54.12 110.865 179.897 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 116' ' ' TRP . . . . . 0.452 ' CZ3' HD11 ' A' ' 226' ' ' LEU . 14.5 m95 -70.23 -50.09 43.42 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.243 -0.435 . . . . 75.23 110.928 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 117' ' ' GLY . . . . . 0.433 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -66.34 -36.42 91.63 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.781 -0.724 . . . . 73.32 112.529 179.872 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 43.2 mtmt -61.66 -16.52 49.45 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.706 0.289 . . . . 72.42 110.838 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.704 ' HB3' HG23 ' A' ' 231' ' ' ILE . 71.3 mm-40 -101.32 13.42 35.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.276 -0.42 . . . . 75.24 110.875 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 1.021 HD12 HD12 ' A' ' 122' ' ' LEU . 5.3 pt -148.26 152.18 38.69 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.656 0.741 . . . . 71.34 111.134 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.66 4.7 1.99 Allowed 'Trans proline' 0 C--O 1.232 0.212 0 C-N-CA 122.718 2.279 . . . . 72.21 112.387 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 1.021 HD12 HD12 ' A' ' 120' ' ' ILE . 10.2 mt -60.72 -158.34 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.243 -0.435 . . . . 73.22 110.936 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.415 ' H ' ' HB3' ' A' ' 122' ' ' LEU . 29.9 t-80 -161.7 140.69 9.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.144 -0.48 . . . . 74.12 110.809 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 124' ' ' PHE . . . . . 0.411 ' CD2' HD21 ' A' ' 113' ' ' LEU . 37.9 m-85 -125.0 148.41 48.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.192 -0.458 . . . . 75.54 110.875 -179.907 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.684 ' HB3' HG22 ' A' ' 90' ' ' THR . 0.0 OUTLIER -124.38 141.09 52.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.154 -0.476 . . . . 75.14 110.854 -179.896 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.98 139.87 35.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.217 -0.447 . . . . 72.22 110.927 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 127' ' ' VAL . . . . . 0.939 HG11 ' HB2' ' A' ' 132' ' ' ALA . 17.3 m -102.81 131.97 49.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.151 -0.477 . . . . 50.13 111.15 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.451 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -144.41 -23.14 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.219 -0.446 . . . . 74.43 111.132 179.894 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 129' ' ' TRP . . . . . 0.451 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -138.77 109.1 6.47 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.188 -0.46 . . . . 71.25 110.896 -179.997 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 108.18 -159.84 14.12 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.714 -0.755 . . . . 62.11 112.501 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -101.89 155.66 18.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.792 0.33 . . . . 63.25 111.15 -179.877 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 132' ' ' ALA . . . . . 0.939 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -112.22 165.24 12.34 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.181 -0.463 . . . . 51.34 111.088 179.865 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -67.44 -62.8 1.24 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.181 -0.463 . . . . 75.41 110.895 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 134' ' ' ILE . . . . . 0.441 HG23 ' HA ' ' A' ' 169' ' ' ASP . 45.5 mt -87.67 139.8 16.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.227 -0.442 . . . . 70.51 111.163 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 135' ' ' MET . . . . . 0.504 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 16.4 mmm -114.33 130.19 56.66 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.2 -0.455 . . . . 72.43 110.904 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.426 HG21 ' CG1' ' A' ' 109' ' ' VAL . 0.3 OUTLIER -111.17 88.15 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.3 -0.409 . . . . 70.04 111.119 179.969 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 137' ' ' GLY . . . . . 0.415 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -134.11 157.27 22.78 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.673 -0.775 . . . . 63.34 112.389 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 138' ' ' PHE . . . . . 0.579 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 31.2 p90 -105.43 151.62 24.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.886 0.374 . . . . 74.01 110.871 -179.865 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.579 ' HB2' ' O ' ' A' ' 138' ' ' PHE . . . 169.64 168.81 0.05 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.197 -0.456 . . . . 71.21 111.089 179.901 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 18.1 mtp180 -102.64 172.87 6.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.18 -0.463 . . . . 62.21 110.849 -179.852 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -54.03 -17.43 7.43 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.707 -0.759 . . . . 74.24 112.54 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -85.58 13.09 7.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.865 0.364 . . . . 75.03 111.188 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 5.1 p80 -85.91 1.91 48.12 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.21 -0.45 . . . . 71.11 110.864 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 106.07 38.47 2.31 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.764 -0.732 . . . . 45.51 112.465 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -139.71 176.47 8.71 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.844 0.354 . . . . 72.14 110.882 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 66.9 m -85.7 166.76 15.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.222 -0.445 . . . . 51.25 110.844 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 66.23 127.73 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.69 0.757 . . . . 73.4 110.89 -179.905 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.74 152.41 69.41 Favored 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.709 2.273 . . . . 74.53 112.408 179.882 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 149' ' ' PHE . . . . . 0.43 ' C ' ' H ' ' A' ' 151' ' ' GLY . 1.5 p90 -52.65 -25.58 11.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.26 -0.427 . . . . 63.52 110.887 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 75.97 -20.87 0.33 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.179 -0.464 . . . . 63.11 110.875 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 151' ' ' GLY . . . . . 0.43 ' H ' ' C ' ' A' ' 149' ' ' PHE . . . 81.44 -161.29 42.69 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.73 -0.748 . . . . 71.41 112.417 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.68 141.88 46.76 Favored 'Trans proline' 0 C--N 1.343 0.243 0 C-N-CA 122.683 2.255 . . . . 75.11 112.403 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 103.71 -133.29 11.4 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.746 -0.74 . . . . 70.32 112.497 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -37.34 148.31 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.943 0.401 . . . . 73.25 110.855 -179.847 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 155' ' ' THR . . . . . 0.787 HG23 ' CA ' ' A' ' 68' ' ' GLY . 59.6 m 65.72 115.11 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.142 -0.481 . . . . 44.41 111.108 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 156' ' ' LEU . . . . . 1.032 HD21 HG21 ' A' ' 186' ' ' ILE . 1.0 OUTLIER -103.9 -52.72 2.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.179 -0.464 . . . . 75.02 110.897 179.975 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 157' ' ' ALA . . . . . 0.564 ' HB1' ' O ' ' A' ' 171' ' ' HIS . . . -153.76 148.27 26.16 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.235 -0.438 . . . . 71.42 111.073 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 26.3 p-80 -111.01 117.49 33.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.21 -0.45 . . . . 72.02 110.831 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -109.81 148.3 31.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.221 -0.445 . . . . 74.42 111.071 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 -104.06 169.5 8.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.172 -0.467 . . . . 75.31 110.836 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 161' ' ' ALA . . . . . 0.612 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -104.42 161.47 22.77 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.575 0.703 . . . . 61.04 111.161 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 162' ' ' PRO . . . . . 0.612 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.9 Cg_endo -69.68 88.11 0.53 Allowed 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.724 2.283 . . . . 74.44 112.348 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 163' ' ' GLY . . . . . 0.407 ' HA2' ' HG3' ' A' ' 79' ' ' PRO . . . -146.43 136.78 6.44 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.767 -0.73 . . . . 61.41 112.463 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 2.7 m 72.24 -69.2 0.19 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.82 0.343 . . . . 73.1 111.122 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . 160.44 -59.49 0.31 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.76 -0.733 . . . . 74.03 112.527 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 166' ' ' LEU . . . . . 0.414 ' C ' HD23 ' A' ' 166' ' ' LEU . 10.3 tt -54.07 -35.13 61.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.865 0.364 . . . . 65.12 110.944 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -74.28 -163.75 10.07 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.726 -0.75 . . . . 43.43 112.494 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 73.13 11.9 79.32 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.676 -0.773 . . . . 74.31 112.435 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 169' ' ' ASP . . . . . 0.441 ' HA ' HG23 ' A' ' 134' ' ' ILE . 61.7 m-20 -91.51 171.38 9.23 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.829 0.347 . . . . 63.41 110.855 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -117.5 131.58 56.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.211 -0.45 . . . . 74.21 111.082 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 171' ' ' HIS . . . . . 0.564 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 28.7 m170 -124.72 158.86 32.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.21 -0.45 . . . . 72.53 110.854 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 172' ' ' PHE . . . . . 0.438 ' HB3' ' CZ2' ' A' ' 178' ' ' TRP . 25.0 m-85 -134.03 143.99 48.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.183 -0.462 . . . . 71.44 110.896 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 173' ' ' ASP . . . . . 0.438 ' CB ' ' O ' ' A' ' 156' ' ' LEU . 49.1 t0 -71.07 103.28 2.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.109 -0.496 . . . . 74.11 110.829 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 174' ' ' GLU . . . . . 0.454 ' HB2' ' C ' ' A' ' 139' ' ' ALA . 0.5 OUTLIER -58.27 -16.92 15.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.158 -0.474 . . . . 72.25 110.907 -179.939 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -77.85 -15.16 59.26 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.148 -0.478 . . . . 73.32 110.851 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -89.73 176.78 6.72 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.202 -0.454 . . . . 63.2 110.878 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 77.8 mtt180 -103.02 123.05 45.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.143 -0.481 . . . . 63.14 110.882 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 178' ' ' TRP . . . . . 0.488 ' HB2' HG21 ' A' ' 97' ' ' THR . 44.4 m95 -117.48 132.38 56.56 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.217 -0.447 . . . . 72.31 110.904 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 179' ' ' THR . . . . . 0.597 HG21 ' HB3' ' A' ' 182' ' ' SER . 3.5 t -177.46 164.13 2.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.235 -0.439 . . . . 74.13 111.15 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 180' ' ' ASP . . . . . 0.745 ' H ' HD21 ' A' ' 100' ' ' LEU . 3.9 t70 -124.03 -68.77 0.85 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.211 -0.45 . . . . 45.33 110.818 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -66.15 -10.87 53.8 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.772 -0.728 . . . . 62.41 112.548 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 182' ' ' SER . . . . . 0.597 ' HB3' HG21 ' A' ' 179' ' ' THR . 0.2 OUTLIER -97.65 -24.34 15.56 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.887 0.375 . . . . 64.5 110.854 -179.766 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 183' ' ' SER . . . . . 0.435 ' C ' ' O ' ' A' ' 182' ' ' SER . 1.8 p 34.55 65.43 0.34 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.133 -0.485 . . . . 64.12 110.815 -179.838 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -117.1 -33.76 4.6 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.157 -0.474 . . . . 74.2 110.895 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -124.54 -136.33 4.6 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.797 -0.716 . . . . 73.01 112.508 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 186' ' ' ILE . . . . . 1.032 HG21 HD21 ' A' ' 156' ' ' LEU . 7.3 mm -79.21 105.88 9.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-O 120.872 0.368 . . . . 73.22 111.092 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -51.07 123.9 10.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.138 -0.483 . . . . 71.31 110.838 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 188' ' ' PHE . . . . . 0.755 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 4.3 t80 -53.6 -35.52 60.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.171 -0.468 . . . . 75.45 110.896 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 189' ' ' LEU . . . . . 0.589 HD21 ' HB3' ' A' ' 111' ' ' LYS . 0.1 OUTLIER -67.46 -47.38 70.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.113 -0.494 . . . . 52.02 110.915 -179.892 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -66.06 -37.55 86.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.159 -0.473 . . . . 74.22 110.948 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -72.54 -35.34 68.02 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.109 -0.496 . . . . 50.03 111.095 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 192' ' ' ALA . . . . . 0.705 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -60.8 -44.62 96.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.235 -0.439 . . . . 52.11 111.04 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -58.1 -44.47 87.69 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.219 -0.446 . . . . 72.43 111.162 -179.884 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 2.8 t60 -72.58 -42.76 64.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.138 -0.483 . . . . 71.44 110.842 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -68.84 -47.23 66.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.233 -0.44 . . . . 71.01 111.114 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 196' ' ' LEU . . . . . 0.835 HD12 HD12 ' A' ' 113' ' ' LEU . 4.5 mm? -63.13 -43.61 97.91 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.239 -0.437 . . . . 74.51 110.912 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -56.2 -29.29 56.02 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.707 -0.758 . . . . 52.23 112.522 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 198' ' ' HIS . . . . . 0.481 ' CD2' HG21 ' A' ' 69' ' ' VAL . 5.9 m-70 -68.03 -40.32 82.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.864 0.364 . . . . 75.21 110.899 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.85 -21.17 62.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.17 -0.468 . . . . 71.13 110.828 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 200' ' ' LEU . . . . . 0.499 ' HA ' ' CD1' ' A' ' 84' ' ' TRP . 0.6 OUTLIER -90.44 2.75 55.35 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.147 -0.479 . . . . 64.13 110.915 179.992 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 83.71 -4.03 83.5 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.729 -0.748 . . . . 50.41 112.483 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 202' ' ' MET . . . . . 0.496 ' SD ' HD12 ' A' ' 234' ' ' ILE . 97.9 mmm -63.85 133.46 53.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.789 0.328 . . . . 63.21 110.877 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -101.48 -176.34 28.6 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.781 -0.724 . . . . 64.44 112.526 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 20.7 m-70 -73.84 144.34 45.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.798 0.332 . . . . 74.32 110.893 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -103.93 153.46 20.77 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.249 -0.432 . . . . 53.34 110.838 -179.776 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 206' ' ' SER . . . . . 0.411 ' HB2' ' HA3' ' A' ' 47' ' ' GLY . 6.5 p -87.79 -4.78 58.86 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.486 . . . . 72.22 110.814 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.55 137.82 83.4 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.619 0.723 . . . . 65.11 110.881 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 -6.62 19.01 Favored 'Trans proline' 0 C--N 1.342 0.222 0 C-N-CA 122.682 2.254 . . . . 74.53 112.336 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -127.92 30.16 5.31 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.189 -0.46 . . . . 63.52 110.886 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 210' ' ' ALA . . . . . 0.48 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.22 145.51 26.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.194 -0.457 . . . . 62.23 111.132 179.851 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 211' ' ' VAL . . . . . 0.409 HG12 ' OD2' ' A' ' 230' ' ' ASP . 0.4 OUTLIER -68.35 -27.52 37.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.238 -0.437 . . . . 62.04 111.145 179.954 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -98.25 10.53 40.41 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.209 -0.451 . . . . 75.22 110.846 179.943 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 213' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -55.71 118.08 18.19 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.698 0.761 . . . . 73.43 110.909 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.82 -18.47 36.71 Favored 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 122.611 2.207 . . . . 63.01 112.363 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 215' ' ' THR . . . . . 0.573 HG23 ' CG2' ' A' ' 61' ' ' ILE . 0.3 OUTLIER -84.79 49.97 1.82 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.174 -0.466 . . . . 74.24 111.172 179.988 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -57.02 124.22 17.93 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.202 -0.454 . . . . 74.14 110.925 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . 128.8 67.15 0.12 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.753 -0.736 . . . . 74.22 112.512 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -130.0 -74.78 0.54 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.901 0.381 . . . . 64.22 110.907 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . -136.08 171.76 22.65 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.766 -0.731 . . . . 72.24 112.536 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 220' ' ' ASP . . . . . 0.405 ' HA ' ' HD2' ' A' ' 221' ' ' PRO . 0.3 OUTLIER -120.31 101.52 46.66 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 121.625 0.726 . . . . 41.43 110.833 -179.954 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 221' ' ' PRO . . . . . 0.405 ' HD2' ' HA ' ' A' ' 220' ' ' ASP . 53.5 Cg_endo -69.83 168.19 22.37 Favored 'Trans proline' 0 C--N 1.341 0.143 0 C-N-CA 122.732 2.288 . . . . 73.42 112.309 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -75.01 -44.96 45.11 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.182 -0.463 . . . . 74.21 110.909 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -127.3 -40.12 1.84 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.268 -0.424 . . . . 60.33 110.852 -179.924 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER 66.58 134.73 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.155 -0.475 . . . . 65.01 110.938 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -143.87 -167.9 2.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.087 -0.506 . . . . 64.24 110.919 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 226' ' ' LEU . . . . . 0.684 ' HB3' HD11 ' A' ' 231' ' ' ILE . 0.6 OUTLIER -59.56 149.2 30.73 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.262 -0.426 . . . . 53.44 110.939 179.885 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 227' ' ' SER . . . . . 0.48 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 1.4 t -86.93 154.84 20.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 74.21 110.932 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -62.82 -65.35 0.7 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.214 -0.448 . . . . 74.54 110.897 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -55.59 -26.09 41.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.225 -0.443 . . . . 72.22 110.863 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 230' ' ' ASP . . . . . 0.409 ' OD2' HG12 ' A' ' 211' ' ' VAL . 21.4 m-20 -69.64 -48.25 60.58 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.198 -0.456 . . . . 74.23 110.872 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 231' ' ' ILE . . . . . 0.704 HG23 ' HB3' ' A' ' 119' ' ' GLU . 8.6 mt -68.29 -42.82 84.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.171 -0.468 . . . . 73.41 111.211 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.21 -32.58 74.02 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.104 -0.498 . . . . 65.42 110.888 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -65.8 -48.3 68.01 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.748 -0.739 . . . . 63.43 112.495 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 234' ' ' ILE . . . . . 0.496 HD12 ' SD ' ' A' ' 202' ' ' MET . 11.8 tt -72.82 -30.61 33.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.79 0.328 . . . . 71.54 111.113 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -70.24 -24.03 63.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.147 -0.479 . . . . 70.33 110.907 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 236' ' ' LYS . . . . . 0.418 ' HE2' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.49 -27.29 60.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.199 -0.455 . . . . 51.21 110.908 179.974 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 237' ' ' LEU . . . . . 0.695 HD13 ' CE ' ' A' ' 83' ' ' LYS . 9.8 tt -98.03 -32.55 11.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.167 -0.47 . . . . 75.41 110.911 179.922 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 238' ' ' TYR . . . . . 0.438 ' CE2' HD11 ' A' ' 122' ' ' LEU . 32.4 m-85 -91.87 -35.18 14.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.2 -0.455 . . . . 51.24 110.917 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -113.0 -120.47 3.7 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.746 -0.74 . . . . 32.22 112.494 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 1.2 tmtm? -100.66 131.59 46.49 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.811 0.339 . . . . 75.42 110.839 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.15 146.25 23.72 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.194 -0.457 . . . . 73.34 110.829 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -161.27 27.44 0.13 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.191 -0.458 . . . . 62.42 110.866 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 65.14 152.48 0.05 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.148 -0.478 . . . . 72.13 110.823 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -179.57 -169.78 0.15 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.164 -0.471 . . . . 62.23 110.908 -179.862 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.63 166.04 16.17 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.158 -0.474 . . . . 70.43 110.886 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -152.11 162.91 40.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.273 -0.421 . . . . 72.11 110.85 -180.0 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 116.177 -0.465 . . . . 74.13 110.838 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 302' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' -2' ' ' LEU . . . . . 0.611 ' N ' ' HD2' ' A' ' -1' ' ' PRO . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.098 0 CA-C-O 121.6 0.714 . . . . 73.02 110.899 . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' -1' ' ' PRO . . . . . 0.611 ' HD2' ' N ' ' A' ' -2' ' ' LEU . 53.7 Cg_endo -69.76 -172.98 0.63 Allowed 'Trans proline' 0 C--O 1.233 0.245 0 C-N-CA 122.729 2.286 . . . . 71.15 112.356 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 1.2 mp -122.24 160.64 46.9 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 121.594 0.712 . . . . 62.13 110.949 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.65 -11.97 32.11 Favored 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.687 2.258 . . . . 64.14 112.317 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -95.24 35.73 1.28 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.241 -0.436 . . . . 60.51 110.916 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -95.41 -27.99 15.16 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.247 -0.433 . . . . 74.01 110.836 -179.855 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -70.25 -34.18 72.52 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.135 -0.484 . . . . 71.4 111.114 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -55.99 -24.83 44.01 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.703 -0.76 . . . . 60.51 112.499 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -108.74 21.59 27.57 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.75 -0.738 . . . . 54.22 112.443 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 15.7 mtm -94.45 163.34 13.45 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.744 0.307 . . . . 72.23 110.922 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -115.52 168.83 9.66 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.308 -0.406 . . . . 73.24 110.871 -179.823 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -54.47 -31.8 56.44 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.157 -0.474 . . . . 50.12 110.9 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.48 -42.95 99.84 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.151 -0.477 . . . . 72.33 110.902 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.54 -41.22 98.47 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.163 -0.471 . . . . 72.14 110.896 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 5.4 t-105 -73.29 -33.6 65.31 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.159 -0.473 . . . . 71.22 110.933 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -73.31 -39.16 65.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.259 -0.428 . . . . 72.51 110.921 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 -74.05 -35.97 64.35 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.135 -0.484 . . . . 61.24 110.93 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.575 ' CB ' HD11 ' A' ' 59' ' ' ILE . . . -56.91 -44.16 82.13 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.225 -0.443 . . . . 54.34 111.123 179.894 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -73.53 -37.41 65.62 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.189 -0.46 . . . . 73.12 110.889 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -67.92 -30.98 70.44 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.174 -0.466 . . . . 72.4 110.93 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -69.95 -35.99 74.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.207 -0.451 . . . . 75.11 110.944 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.485 HD11 ' SD ' ' A' ' 42' ' ' MET . 0.4 OUTLIER -68.78 -20.93 64.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.17 -0.468 . . . . 72.51 110.923 179.985 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.405 ' HG2' ' N ' ' A' ' 21' ' ' ARG . 5.7 ptmt -74.85 -31.48 61.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.168 -0.469 . . . . 74.41 110.903 179.788 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.405 ' N ' ' HG2' ' A' ' 20' ' ' LYS . 2.2 ptp180 -86.37 -27.93 23.94 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.202 -0.454 . . . . 74.05 110.896 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.0 m-30 -77.82 -0.84 28.78 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.256 -0.429 . . . . 74.31 110.856 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.406 ' O ' ' HB2' ' A' ' 70' ' ' PRO . 2.9 m-85 -120.43 -75.34 0.59 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.112 -0.495 . . . . 72.55 110.946 -179.808 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.824 ' HG ' HG23 ' A' ' 72' ' ' VAL . 11.9 mt -160.93 155.37 23.31 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.147 -0.478 . . . . 75.43 110.934 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -82.61 89.16 6.68 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.264 -0.425 . . . . 71.41 110.9 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -125.19 131.34 53.21 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.104 -0.498 . . . . 74.25 110.911 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 84.7 p -85.15 -14.05 48.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.235 -0.439 . . . . 62.15 110.825 -179.77 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -70.03 -11.4 60.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.194 -0.457 . . . . 74.51 110.951 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.65 1.84 32.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.174 -0.466 . . . . 70.44 111.136 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 3.0 pttt -51.72 170.13 0.06 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.207 -0.451 . . . . 73.33 110.885 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.403 ' O ' HD23 ' A' ' 35' ' ' LEU . 6.4 m-20 67.14 123.54 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.224 -0.444 . . . . 64.43 110.863 179.91 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.47 ' HA ' HD23 ' A' ' 35' ' ' LEU . . . -61.18 -24.1 66.07 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.177 -0.465 . . . . 70.21 111.168 179.829 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -65.45 -32.28 73.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.21 -0.45 . . . . 35.31 110.884 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 11.0 m -85.56 -20.12 30.07 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.18 -0.464 . . . . 74.02 110.862 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.618 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 3.6 mm? -62.34 -35.83 80.32 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.15 -0.477 . . . . 72.52 110.901 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.472 ' HA ' HD12 ' A' ' 39' ' ' LEU . 0.9 OUTLIER -56.75 -50.37 72.46 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.165 -0.47 . . . . 73.13 110.88 179.916 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -52.64 -36.56 56.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.161 -0.472 . . . . 63.32 111.111 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.465 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.1 OUTLIER -70.7 -41.61 71.73 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.182 -0.463 . . . . 72.32 110.92 179.931 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.618 ' HG ' ' O ' ' A' ' 35' ' ' LEU . 25.4 mt -54.32 -38.05 65.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.215 -0.448 . . . . 72.11 110.951 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.0 mttt -58.72 -45.57 89.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.16 -0.473 . . . . 62.43 110.929 179.779 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.465 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 2.3 pt-20 -60.93 -32.68 72.17 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.219 -0.446 . . . . 75.11 110.912 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.707 ' HE1' HG13 ' A' ' 58' ' ' VAL . 4.5 ttt -66.83 -34.16 77.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.15 -0.477 . . . . 63.43 110.926 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.756 ' OE1' HD11 ' A' ' 48' ' ' LEU . 2.5 mm-40 -58.67 -40.05 82.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.455 . . . . 74.45 110.89 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.7 mmpt? -72.79 -33.49 66.3 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.233 -0.44 . . . . 71.43 110.875 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 32.7 t80 -71.0 -37.18 72.67 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.26 -0.427 . . . . 73.32 110.848 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.526 ' CB ' HD23 ' A' ' 48' ' ' LEU . 6.8 m-85 -81.78 -35.22 29.8 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.22 -0.446 . . . . 70.43 110.931 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 105.83 -10.34 44.76 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.748 -0.739 . . . . 64.34 112.509 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.756 HD11 ' OE1' ' A' ' 43' ' ' GLN . 0.9 OUTLIER -66.0 135.79 95.35 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.619 0.723 . . . . 64.11 110.898 -179.906 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.76 -52.9 0.3 Allowed 'Trans proline' 0 C--N 1.342 0.228 0 C-N-CA 122.697 2.264 . . . . 74.5 112.325 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.455 ' O ' HD12 ' A' ' 48' ' ' LEU . 0.9 OUTLIER -52.67 108.22 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.205 -0.452 . . . . 71.22 111.13 179.949 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.687 HG22 ' CB ' ' A' ' 43' ' ' GLN . 21.1 p -107.88 168.09 9.52 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.165 -0.47 . . . . 73.25 111.126 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 60.16 16.92 43.49 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.688 -0.768 . . . . 64.24 112.494 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.568 ' O ' HG21 ' A' ' 58' ' ' VAL . 1.0 OUTLIER -128.12 134.02 49.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.772 0.32 . . . . 75.23 110.844 -179.907 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.43 ' HA ' ' HB ' ' A' ' 58' ' ' VAL . 24.6 tp -145.36 93.1 2.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.193 -0.458 . . . . 73.4 110.892 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.6 p30 174.38 -29.68 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.219 -0.446 . . . . 44.35 110.925 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 24.1 t -83.86 -97.68 0.06 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.151 -0.477 . . . . 75.25 110.833 -179.832 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 8.8 tpt180 -85.09 -33.05 22.5 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.14 -0.482 . . . . 61.22 110.949 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.707 HG13 ' HE1' ' A' ' 42' ' ' MET . 44.7 t -59.06 -49.34 83.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.191 -0.459 . . . . 70.12 111.148 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.575 HD11 ' CB ' ' A' ' 15' ' ' ALA . 0.5 OUTLIER -63.99 -30.9 51.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.162 -0.472 . . . . 74.43 111.082 179.913 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.01 -40.4 84.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.261 -0.427 . . . . 73.45 110.931 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.689 HD13 HG22 ' A' ' 215' ' ' THR . 0.8 OUTLIER -78.26 -30.1 15.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.133 -0.485 . . . . 74.52 111.144 179.937 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 7.9 mmm -68.18 -35.14 77.55 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.181 -0.463 . . . . 74.01 110.893 179.875 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -83.87 -24.33 30.91 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.182 -0.463 . . . . 42.22 110.918 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.25 148.48 50.11 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.54 0.686 . . . . 65.34 110.958 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.8 154.22 67.85 Favored 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.663 2.242 . . . . 72.11 112.344 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 40.9 ttp180 -153.38 -84.02 0.07 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.225 -0.443 . . . . 71.51 110.872 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -145.48 156.19 43.57 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.178 -0.465 . . . . 55.3 110.925 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.527 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -100.12 20.55 48.39 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.701 -0.762 . . . . 64.23 112.488 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.763 HG12 ' HD2' ' A' ' 70' ' ' PRO . 0.0 OUTLIER -111.29 141.88 25.28 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.725 0.774 . . . . 74.23 111.122 179.979 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.763 ' HD2' HG12 ' A' ' 69' ' ' VAL . 54.4 Cg_endo -69.71 139.02 39.36 Favored 'Trans proline' 0 C--N 1.342 0.207 0 C-N-CA 122.736 2.291 . . . . 63.44 112.349 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 87.7 m-20 -61.55 -17.01 53.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.191 -0.459 . . . . 74.45 110.89 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.824 HG23 ' HG ' ' A' ' 24' ' ' LEU . 0.3 OUTLIER -139.96 129.01 27.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.186 -0.461 . . . . 53.43 111.165 179.986 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -131.78 151.8 51.4 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.179 -0.464 . . . . 73.13 111.119 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 172.33 87.77 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.233 -0.44 . . . . 73.31 110.921 -179.948 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 28.0 p90 -175.13 170.16 3.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.131 -0.486 . . . . 70.41 110.944 -179.777 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.445 ' O ' ' OG ' ' A' ' 76' ' ' SER . 2.4 p 64.53 100.43 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.138 -0.483 . . . . 74.2 110.859 -179.828 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.446 HD22 ' OG1' ' A' ' 164' ' ' THR . 0.1 OUTLIER 73.84 -42.11 0.51 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.087 -0.506 . . . . 70.34 110.897 179.952 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 78' ' ' PHE . . . . . 0.406 ' H ' ' C ' ' A' ' 76' ' ' SER . 47.1 m-85 61.74 66.71 1.45 Allowed Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.592 0.71 . . . . 71.24 110.906 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.429 ' HG3' ' HA3' ' A' ' 163' ' ' GLY . 54.0 Cg_endo -69.75 -174.86 0.98 Allowed 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.634 2.223 . . . . 73.34 112.359 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 50.6 m-80 -118.0 148.28 42.38 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.202 -0.454 . . . . 74.43 110.853 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.3 t 65.1 115.42 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.615 0.722 . . . . 70.4 110.838 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.86 -37.97 8.22 Favored 'Trans proline' 0 C--O 1.231 0.125 0 C-N-CA 122.714 2.276 . . . . 71.11 112.29 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.697 ' HD2' HD22 ' A' ' 237' ' ' LEU . 1.9 mttp -82.33 163.35 21.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.24 -0.436 . . . . 64.45 110.905 179.874 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' TRP . . . . . 0.502 ' CD1' ' HA ' ' A' ' 200' ' ' LEU . 47.0 m95 -62.95 135.2 57.17 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.226 -0.443 . . . . 73.31 110.955 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.35 1.37 13.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.303 -0.408 . . . . 65.3 111.154 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -77.81 163.71 25.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.152 -0.476 . . . . 70.34 110.908 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.72 -6.81 59.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.156 -0.475 . . . . 71.12 110.929 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -170.51 138.83 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.206 -0.452 . . . . 74.14 111.141 179.9 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 95.9 t -123.39 135.62 62.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.234 -0.439 . . . . 72.25 111.088 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.693 HG22 ' HB3' ' A' ' 125' ' ' ARG . 9.5 p -115.07 168.1 10.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.155 -0.475 . . . . 71.01 111.142 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.404 ' N ' ' CD1' ' A' ' 91' ' ' TYR . 2.9 p90 -144.58 147.42 33.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.18 -0.464 . . . . 70.51 110.947 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.408 ' CB ' ' HB3' ' A' ' 132' ' ' ALA . 5.4 tpt85 -148.03 134.72 19.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.138 -0.483 . . . . 71.25 110.871 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.437 HD11 ' HA ' ' A' ' 106' ' ' ASP . 10.2 mm -77.21 135.32 26.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.183 -0.462 . . . . 72.4 111.128 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.473 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 18.3 t -93.98 -40.5 11.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.22 -0.445 . . . . 60.2 111.138 179.857 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -151.63 169.56 21.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.081 -0.509 . . . . 64.24 110.848 -179.865 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 16.1 p90 -130.12 155.24 46.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.141 -0.481 . . . . 72.25 110.971 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.5 t -100.64 142.19 32.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 64.11 111.136 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -52.08 -18.46 1.44 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.215 -0.448 . . . . 72.14 110.859 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.97 -36.7 85.23 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.186 -0.461 . . . . 74.13 110.863 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.435 HD23 HG21 ' A' ' 104' ' ' THR . 1.7 mp -144.07 152.81 55.72 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-O 121.623 0.725 . . . . 72.52 110.934 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' PRO . . . . . 0.57 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.7 Cg_endo -69.83 151.27 68.6 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.662 2.241 . . . . 73.11 112.319 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 2.7 t-160 -50.8 -28.3 9.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.18 -0.464 . . . . 74.11 110.88 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.57 HG22 ' HB2' ' A' ' 101' ' ' PRO . 2.7 tp -75.65 -38.32 37.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.205 -0.452 . . . . 74.02 111.068 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' THR . . . . . 0.771 ' O ' HD22 ' A' ' 108' ' ' LEU . 3.1 m -69.21 -37.88 78.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.168 -0.469 . . . . 52.11 111.125 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.805 ' O ' HG13 ' A' ' 109' ' ' VAL . 65.5 t -71.68 -44.48 69.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.214 -0.448 . . . . 71.51 111.15 179.885 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.648 ' O ' HG22 ' A' ' 109' ' ' VAL . 26.9 t0 -63.96 -38.55 91.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 63.44 110.85 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' ARG . . . . . 0.498 ' HG3' ' N ' ' A' ' 108' ' ' LEU . 0.0 OUTLIER -70.55 -33.44 71.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.189 -0.46 . . . . 75.02 110.875 -179.89 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.771 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -66.21 -48.55 70.25 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.201 -0.454 . . . . 71.04 110.922 -179.993 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.805 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.5 m -55.01 -43.17 68.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.189 -0.459 . . . . 72.31 111.06 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.487 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 45.3 t -70.65 -33.93 71.49 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.194 -0.457 . . . . 72.14 110.869 -179.789 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.48 ' HB3' HD21 ' A' ' 189' ' ' LEU . 0.3 OUTLIER -62.1 -33.17 73.94 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.087 -0.506 . . . . 74.35 110.928 179.927 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.71 -40.27 9.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.244 -0.434 . . . . 74.32 111.135 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.788 HD12 HD12 ' A' ' 196' ' ' LEU . 0.4 OUTLIER -64.32 -33.04 74.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.135 -0.484 . . . . 72.0 110.915 179.981 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 45.0 t30 -69.82 -40.14 76.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.174 -0.466 . . . . 72.34 110.876 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' MET . . . . . 0.441 ' HB3' HD23 ' A' ' 226' ' ' LEU . 0.4 OUTLIER -59.71 -34.33 72.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.163 -0.471 . . . . 54.12 110.921 179.905 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 116' ' ' TRP . . . . . 0.554 ' CZ3' HD11 ' A' ' 226' ' ' LEU . 13.3 m95 -65.8 -52.24 52.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.223 -0.444 . . . . 75.23 110.922 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 117' ' ' GLY . . . . . 0.447 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -63.52 -34.01 88.8 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.694 -0.765 . . . . 73.32 112.497 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.4 mtmt -63.67 -14.44 52.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.752 0.31 . . . . 72.42 110.892 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.425 ' HB3' HG23 ' A' ' 231' ' ' ILE . 61.2 mm-40 -104.04 13.27 32.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.233 -0.44 . . . . 75.24 110.894 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 1.01 HD12 HD12 ' A' ' 122' ' ' LEU . 6.7 pt -147.71 153.13 42.58 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.653 0.74 . . . . 71.34 111.149 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 1.99 3.91 Favored 'Trans proline' 0 C--N 1.342 0.226 0 C-N-CA 122.658 2.239 . . . . 72.21 112.362 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 1.01 HD12 HD12 ' A' ' 120' ' ' ILE . 5.9 mt -61.46 -158.25 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.208 -0.451 . . . . 73.22 110.885 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.405 ' H ' ' HB3' ' A' ' 122' ' ' LEU . 42.5 t-80 -160.15 145.05 14.82 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.116 -0.493 . . . . 74.12 110.843 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 124' ' ' PHE . . . . . 0.5 ' CD2' HD21 ' A' ' 113' ' ' LEU . 42.4 m-85 -126.08 148.94 49.23 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.174 -0.466 . . . . 75.54 110.882 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.693 ' HB3' HG22 ' A' ' 90' ' ' THR . 0.0 OUTLIER -128.01 140.96 51.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.16 -0.473 . . . . 75.14 110.857 -179.921 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 126' ' ' LYS . . . . . 0.401 ' HD3' ' N ' ' A' ' 127' ' ' VAL . 0.0 OUTLIER -81.01 141.19 34.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 72.22 110.869 179.988 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 127' ' ' VAL . . . . . 0.952 HG11 ' HB2' ' A' ' 132' ' ' ALA . 22.2 m -102.92 133.79 45.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.214 -0.448 . . . . 50.13 111.177 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.427 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -147.06 -24.83 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.191 -0.459 . . . . 74.43 111.19 179.886 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 129' ' ' TRP . . . . . 0.427 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -136.72 109.15 7.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.117 -0.492 . . . . 71.25 110.885 179.972 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.44 -159.74 14.39 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.756 -0.735 . . . . 62.11 112.482 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -101.8 155.54 18.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.786 0.326 . . . . 63.25 111.168 -179.88 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 132' ' ' ALA . . . . . 0.952 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -112.07 165.38 12.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.2 -0.455 . . . . 51.34 111.083 179.86 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -66.48 -62.8 1.27 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.191 -0.459 . . . . 75.41 110.853 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 134' ' ' ILE . . . . . 0.494 HG23 ' HA ' ' A' ' 169' ' ' ASP . 37.6 mt -86.41 130.48 36.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.211 -0.45 . . . . 70.51 111.143 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 135' ' ' MET . . . . . 0.473 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 13.7 mmm -107.06 124.9 50.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.12 -0.491 . . . . 72.43 110.914 179.877 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -108.52 92.29 2.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.23 -0.441 . . . . 70.04 111.096 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 137' ' ' GLY . . . . . 0.429 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -130.31 170.15 20.99 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.738 -0.744 . . . . 63.34 112.497 179.865 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 138' ' ' PHE . . . . . 0.462 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 48.2 m-85 -108.61 149.62 28.65 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.875 0.369 . . . . 74.01 110.938 -179.906 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.606 ' HB1' ' CB ' ' A' ' 143' ' ' HIS . . . 175.83 166.91 0.39 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.456 . . . . 71.21 111.1 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 22.2 mtm180 -104.26 173.09 6.45 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.214 -0.448 . . . . 62.21 110.908 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -58.09 -15.73 23.04 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.722 -0.751 . . . . 74.24 112.466 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -99.05 13.36 33.09 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.769 0.319 . . . . 75.03 111.165 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 143' ' ' HIS . . . . . 0.606 ' CB ' ' HB1' ' A' ' 139' ' ' ALA . 5.0 p80 -72.26 -8.86 57.13 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.172 -0.467 . . . . 71.11 110.843 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 117.95 50.38 0.35 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.773 -0.727 . . . . 45.51 112.55 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -172.7 171.86 4.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.808 0.337 . . . . 72.14 110.911 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 27.1 p -64.09 -179.79 0.46 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.18 -0.464 . . . . 51.25 110.849 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 147' ' ' TYR . . . . . 0.44 ' HA ' ' HD2' ' A' ' 148' ' ' PRO . 0.3 OUTLIER 64.48 103.92 0.03 OUTLIER Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.727 0.775 . . . . 73.4 110.949 -179.905 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 148' ' ' PRO . . . . . 0.44 ' HD2' ' HA ' ' A' ' 147' ' ' TYR . 54.2 Cg_endo -69.77 151.97 69.17 Favored 'Trans proline' 0 C--N 1.342 0.228 0 C-N-CA 122.612 2.208 . . . . 74.53 112.372 179.935 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 149' ' ' PHE . . . . . 0.404 ' O ' ' CG ' ' A' ' 150' ' ' ASP . 0.3 OUTLIER -53.38 -24.26 11.83 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.166 -0.47 . . . . 63.52 110.842 -179.942 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 150' ' ' ASP . . . . . 0.404 ' CG ' ' O ' ' A' ' 149' ' ' PHE . 1.9 p30 44.93 25.43 0.15 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.191 -0.459 . . . . 63.11 110.861 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 44.69 -165.05 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.719 -0.753 . . . . 71.41 112.48 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.72 144.36 53.98 Favored 'Trans proline' 0 C--N 1.343 0.24 0 C-N-CA 122.632 2.222 . . . . 75.11 112.36 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 153' ' ' GLY . . . . . 0.457 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 105.57 -131.76 10.8 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.775 -0.726 . . . . 70.32 112.445 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 154' ' ' ASN . . . . . 0.457 ' C ' ' O ' ' A' ' 153' ' ' GLY . 3.5 p30 -33.37 135.82 0.11 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.851 0.358 . . . . 73.25 110.891 -179.875 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 155' ' ' THR . . . . . 0.524 HG23 ' HA2' ' A' ' 68' ' ' GLY . 0.2 OUTLIER 74.24 101.88 0.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.234 -0.439 . . . . 44.41 111.189 -179.965 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 156' ' ' LEU . . . . . 1.045 HD21 HG21 ' A' ' 186' ' ' ILE . 0.4 OUTLIER -82.41 -56.89 3.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.16 -0.473 . . . . 75.02 110.94 179.98 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 157' ' ' ALA . . . . . 0.527 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -162.87 149.09 12.39 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.245 -0.434 . . . . 71.42 111.131 179.769 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 18.9 p-80 -105.19 126.09 51.71 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.267 -0.424 . . . . 72.02 110.809 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -110.53 153.06 25.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.181 -0.463 . . . . 74.42 111.105 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 15.1 m-85 -108.55 152.25 25.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.23 -0.441 . . . . 75.31 110.877 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 161' ' ' ALA . . . . . 0.712 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -96.66 164.16 18.75 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.617 0.722 . . . . 61.04 111.112 179.935 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 162' ' ' PRO . . . . . 0.712 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.5 Cg_endo -69.76 85.33 0.62 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.672 2.248 . . . . 74.44 112.361 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 163' ' ' GLY . . . . . 0.429 ' HA3' ' HG3' ' A' ' 79' ' ' PRO . . . -134.57 127.63 4.55 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.718 -0.753 . . . . 61.41 112.462 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 164' ' ' THR . . . . . 0.446 ' OG1' HD22 ' A' ' 77' ' ' LEU . 2.7 m 72.72 -69.78 0.18 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.847 0.356 . . . . 73.1 111.102 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . 166.61 -59.44 0.23 Allowed Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.767 -0.73 . . . . 74.03 112.454 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 166' ' ' LEU . . . . . 0.484 ' C ' HD23 ' A' ' 166' ' ' LEU . 8.7 tt -53.99 -37.7 64.29 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.741 0.305 . . . . 65.12 110.891 -179.915 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -73.98 -166.19 13.21 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.68 -0.772 . . . . 43.43 112.519 179.85 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 73.01 18.04 78.93 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.642 -0.789 . . . . 74.31 112.483 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 169' ' ' ASP . . . . . 0.494 ' HA ' HG23 ' A' ' 134' ' ' ILE . 74.9 m-20 -91.97 -172.4 3.15 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.796 0.331 . . . . 63.41 110.824 -179.876 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -124.47 131.36 53.49 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.19 -0.459 . . . . 74.21 111.116 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 171' ' ' HIS . . . . . 0.502 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 10.9 m170 -129.0 137.91 51.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.216 -0.447 . . . . 72.53 110.809 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 47.1 m-85 -121.55 140.33 52.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.208 -0.451 . . . . 71.44 110.899 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 55.6 t0 -73.47 100.84 3.35 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.203 -0.453 . . . . 74.11 110.902 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.83 -16.42 11.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.115 -0.493 . . . . 72.25 110.86 -179.886 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -79.03 -16.37 56.94 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.125 -0.489 . . . . 73.32 110.875 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 31.4 mm-40 -83.48 -175.79 5.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.194 -0.457 . . . . 63.2 110.824 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -112.18 116.53 30.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.136 -0.484 . . . . 63.14 110.857 -179.884 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 49.6 m95 -116.82 139.41 50.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.176 -0.466 . . . . 72.31 110.947 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 179' ' ' THR . . . . . 0.515 HG21 ' HB3' ' A' ' 182' ' ' SER . 9.0 t -177.46 163.6 1.99 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.221 -0.445 . . . . 74.13 111.231 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -125.12 -68.86 0.82 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.241 -0.436 . . . . 45.33 110.852 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -64.81 -12.15 52.59 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.706 -0.759 . . . . 62.41 112.523 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 182' ' ' SER . . . . . 0.515 ' HB3' HG21 ' A' ' 179' ' ' THR . 0.4 OUTLIER -94.52 -24.44 17.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.925 0.393 . . . . 64.5 110.876 -179.743 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 183' ' ' SER . . . . . 0.425 ' C ' ' O ' ' A' ' 182' ' ' SER . 3.2 p 35.32 58.03 0.82 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.103 -0.499 . . . . 64.12 110.894 -179.821 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -116.85 -33.53 4.75 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.101 -0.5 . . . . 74.2 110.915 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -119.79 -139.37 5.9 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.696 -0.764 . . . . 73.01 112.414 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 186' ' ' ILE . . . . . 1.045 HG21 HD21 ' A' ' 156' ' ' LEU . 6.9 mm -79.47 100.08 3.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.864 0.364 . . . . 73.22 111.118 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 28.6 m-20 -49.19 121.7 5.18 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.195 -0.457 . . . . 71.31 110.944 179.829 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 188' ' ' PHE . . . . . 0.773 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.5 t80 -54.03 -36.25 62.83 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.196 -0.456 . . . . 75.45 110.884 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 189' ' ' LEU . . . . . 0.59 HD12 ' HE2' ' A' ' 224' ' ' PHE . 0.2 OUTLIER -67.57 -47.62 69.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.139 -0.482 . . . . 52.02 110.867 -179.934 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 44.3 t80 -69.48 -38.94 77.92 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.256 -0.429 . . . . 74.22 110.901 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 191' ' ' ALA . . . . . 0.671 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -72.13 -35.23 69.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.154 -0.475 . . . . 50.03 111.133 179.894 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 192' ' ' ALA . . . . . 0.641 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -57.12 -45.02 83.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.161 -0.472 . . . . 52.11 111.031 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.97 -42.71 90.58 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.231 -0.44 . . . . 72.43 111.181 -179.886 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 15.0 t-160 -73.21 -38.56 66.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.228 -0.442 . . . . 71.44 110.909 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -75.38 -48.51 22.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 71.01 111.052 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 196' ' ' LEU . . . . . 0.788 HD12 HD12 ' A' ' 113' ' ' LEU . 4.5 mm? -63.81 -40.02 95.63 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.236 -0.438 . . . . 74.51 110.943 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -58.91 -28.59 63.65 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.742 -0.742 . . . . 52.23 112.436 179.863 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 198' ' ' HIS . . . . . 0.473 ' CD2' HG21 ' A' ' 69' ' ' VAL . 7.1 m-70 -69.29 -32.42 71.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.738 0.304 . . . . 75.21 110.793 -179.892 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -70.94 -21.26 62.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.207 -0.451 . . . . 71.13 110.874 -179.748 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 200' ' ' LEU . . . . . 0.502 ' HA ' ' CD1' ' A' ' 84' ' ' TRP . 0.3 OUTLIER -92.54 4.82 52.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.099 -0.501 . . . . 64.13 110.938 -179.984 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 83.37 -9.52 61.23 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.735 -0.745 . . . . 50.41 112.473 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 202' ' ' MET . . . . . 0.434 ' HE2' ' HB3' ' A' ' 202' ' ' MET . 0.0 OUTLIER -54.83 135.0 48.23 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.88 0.372 . . . . 63.21 110.854 -179.99 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -109.79 159.22 14.08 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.768 -0.73 . . . . 64.44 112.409 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 12.4 m-70 -52.47 155.78 2.02 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.88 0.371 . . . . 74.32 110.837 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 205' ' ' SER . . . . . 0.427 ' HB2' ' HB1' ' A' ' 210' ' ' ALA . 0.5 OUTLIER -117.27 153.01 33.67 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.182 -0.463 . . . . 53.34 110.855 -179.784 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 5.2 p -87.73 -4.9 58.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.157 -0.474 . . . . 72.22 110.859 -179.867 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -71.65 140.53 84.26 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.657 0.741 . . . . 65.11 110.886 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.82 -6.32 18.34 Favored 'Trans proline' 0 C--N 1.342 0.21 0 C-N-CA 122.693 2.262 . . . . 74.53 112.332 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 2.9 p30 -126.85 32.25 5.15 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.23 -0.441 . . . . 63.52 110.874 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 210' ' ' ALA . . . . . 0.492 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.11 146.07 26.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 62.23 111.103 179.845 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -73.63 -27.09 22.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 62.04 111.148 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 3.2 mmm -97.54 14.1 27.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.194 -0.457 . . . . 75.22 110.876 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 213' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -55.23 121.98 40.23 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-O 121.612 0.72 . . . . 73.43 110.992 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.73 -18.79 36.94 Favored 'Trans proline' 0 N--CA 1.465 -0.203 0 C-N-CA 122.716 2.278 . . . . 63.01 112.364 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 215' ' ' THR . . . . . 0.689 HG22 HD13 ' A' ' 61' ' ' ILE . 5.9 p -84.37 53.28 2.59 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.247 -0.433 . . . . 74.24 111.14 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 8.0 t80 -70.73 122.72 20.36 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.224 -0.444 . . . . 74.14 110.955 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -111.81 171.28 14.12 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.718 -0.754 . . . . 74.22 112.387 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -58.25 -56.23 24.71 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.89 0.376 . . . . 64.22 110.902 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . -51.71 102.9 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.785 -0.722 . . . . 72.24 112.474 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 220' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -95.52 153.6 39.46 Favored Pre-proline 0 C--N 1.327 -0.389 0 CA-C-O 121.559 0.695 . . . . 41.43 110.855 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 221' ' ' PRO . . . . . 0.421 ' HG2' ' HB3' ' A' ' 224' ' ' PHE . 52.9 Cg_endo -69.86 168.99 20.11 Favored 'Trans proline' 0 C--O 1.231 0.15 0 C-N-CA 122.662 2.241 . . . . 73.42 112.279 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 4.7 mm100 -70.02 -45.43 67.23 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.212 -0.449 . . . . 74.21 110.913 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -130.24 -40.45 1.29 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.196 -0.456 . . . . 60.33 110.883 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 224' ' ' PHE . . . . . 0.59 ' HE2' HD12 ' A' ' 189' ' ' LEU . 0.0 OUTLIER 65.58 136.66 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.186 -0.461 . . . . 65.01 110.848 179.987 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -143.99 -178.19 5.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.185 -0.461 . . . . 64.24 110.875 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 226' ' ' LEU . . . . . 0.867 ' HB3' HD11 ' A' ' 231' ' ' ILE . 0.7 OUTLIER -59.71 148.02 35.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 53.44 110.909 179.925 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 227' ' ' SER . . . . . 0.492 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 1.4 t -90.71 151.62 21.16 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.198 -0.455 . . . . 74.21 110.826 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 42.6 tt0 -67.46 -60.7 2.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.088 -0.505 . . . . 74.54 110.958 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -58.36 -26.08 62.75 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.214 -0.448 . . . . 72.22 110.865 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -69.78 -48.82 57.82 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.19 -0.459 . . . . 74.23 110.904 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 231' ' ' ILE . . . . . 0.867 HD11 ' HB3' ' A' ' 226' ' ' LEU . 10.5 mt -68.63 -44.83 82.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 73.41 111.153 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.2 -32.77 66.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.176 -0.466 . . . . 65.42 110.902 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -64.26 -49.79 63.99 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.703 -0.76 . . . . 63.43 112.456 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 234' ' ' ILE . . . . . 0.492 HD13 HG21 ' A' ' 120' ' ' ILE . 12.8 tt -73.15 -31.82 36.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.72 0.295 . . . . 71.54 111.115 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -62.65 -24.3 67.54 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.142 -0.481 . . . . 70.33 110.895 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 236' ' ' LYS . . . . . 0.449 ' HE3' ' HB2' ' A' ' 237' ' ' LEU . 0.1 OUTLIER -74.66 -22.11 59.06 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.2 -0.455 . . . . 51.21 110.868 179.994 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 237' ' ' LEU . . . . . 0.697 HD22 ' HD2' ' A' ' 83' ' ' LYS . 10.6 tt -97.34 -33.73 11.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.206 -0.452 . . . . 75.41 110.926 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 238' ' ' TYR . . . . . . . . . . . . . 47.4 m-85 -92.04 -35.31 14.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.174 -0.466 . . . . 51.24 110.902 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -129.38 -120.01 2.21 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.709 -0.757 . . . . 32.22 112.508 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 15.9 tttm -129.27 120.3 25.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.777 0.322 . . . . 75.42 110.922 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 1.2 tpt85 -175.03 -172.03 0.57 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.264 -0.426 . . . . 73.34 110.862 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -134.5 -174.39 3.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.171 -0.468 . . . . 62.42 110.805 -179.715 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 60.39 95.8 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.129 -0.487 . . . . 72.13 110.879 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 44.3 t -120.72 104.73 10.13 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.168 -0.469 . . . . 62.23 110.875 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 1.5 ttm180 -111.99 58.34 0.63 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.135 -0.484 . . . . 70.43 110.876 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -103.76 134.01 47.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.21 -0.45 . . . . 72.11 110.915 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 15.2 mmtt . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.237 -0.438 . . . . 74.13 110.93 179.857 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 302' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' -2' ' ' LEU . . . . . 0.753 ' H3 ' HD22 ' A' ' -2' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.153 0 CA-C-O 121.511 0.672 . . . . 73.02 111.011 . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' -1' ' ' PRO . . . . . 0.632 ' C ' HD13 ' A' ' 0' ' ' LEU . 53.9 Cg_endo -69.69 -170.96 0.42 Allowed 'Trans proline' 0 C--O 1.231 0.131 0 C-N-CA 122.728 2.285 . . . . 71.15 112.303 179.893 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 0' ' ' LEU . . . . . 0.706 HD13 ' N ' ' A' ' 0' ' ' LEU . 0.0 OUTLIER -150.14 63.04 5.93 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.627 0.727 . . . . 62.13 110.908 179.881 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.72 -174.26 0.87 Allowed 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.722 2.281 . . . . 64.14 112.311 179.881 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -133.56 74.71 1.57 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.163 -0.471 . . . . 60.51 110.877 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -95.08 -24.66 16.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.213 -0.449 . . . . 74.01 110.848 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.47 -33.94 66.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.161 -0.472 . . . . 71.4 111.146 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -55.85 -27.27 49.85 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.73 -0.748 . . . . 60.51 112.552 -180.0 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -108.73 19.64 30.53 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.725 -0.75 . . . . 54.22 112.491 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.82 154.86 31.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.828 0.347 . . . . 72.23 110.87 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -115.6 168.76 9.73 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.2 -0.454 . . . . 73.24 110.865 -179.852 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -54.55 -33.14 59.61 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.15 -0.477 . . . . 50.12 110.911 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.49 -42.78 78.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.153 -0.476 . . . . 72.33 110.876 -179.93 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -65.88 -41.13 91.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.228 -0.442 . . . . 72.14 110.879 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.515 ' CE2' HD23 ' A' ' 54' ' ' LEU . 16.0 t-105 -72.83 -44.31 61.58 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.192 -0.458 . . . . 71.22 110.86 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 78.4 tt0 -62.31 -35.25 78.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.222 -0.445 . . . . 72.51 110.814 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 64.0 mm-40 -74.24 -36.61 63.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.171 -0.468 . . . . 61.24 110.914 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.89 -43.78 78.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.202 -0.453 . . . . 54.34 111.125 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.761 ' HB3' HD21 ' A' ' 35' ' ' LEU . 0.0 OUTLIER -73.07 -32.18 64.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.182 -0.463 . . . . 73.12 110.933 -179.938 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 83.4 m-20 -77.66 -30.91 52.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.174 -0.466 . . . . 72.4 110.898 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.97 -35.69 75.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.153 -0.476 . . . . 75.11 110.938 -179.848 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.661 HD13 ' O ' ' A' ' 19' ' ' LEU . 3.0 tm? -71.26 -21.41 62.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.118 -0.492 . . . . 72.51 110.92 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 4.1 ptmt -75.32 -28.6 59.72 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.188 -0.46 . . . . 74.41 110.919 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.8 ptp180 -86.36 -27.11 24.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.213 -0.448 . . . . 74.05 110.912 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -59.67 -25.32 64.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.181 -0.463 . . . . 74.31 110.877 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.566 ' HB3' HG21 ' A' ' 72' ' ' VAL . 14.5 m-85 -92.26 -74.05 0.53 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.125 -0.489 . . . . 72.55 110.924 -179.876 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 83.4 mt -154.43 18.31 0.47 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.077 -0.511 . . . . 75.43 110.865 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 4.1 t80 47.99 89.76 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.191 -0.459 . . . . 71.41 110.891 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -125.06 128.44 48.5 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.123 -0.489 . . . . 74.25 110.845 179.913 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.3 p -74.14 -6.41 47.51 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.197 -0.456 . . . . 62.15 110.871 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.92 -13.11 55.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.115 -0.493 . . . . 74.51 110.888 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.435 HG22 ' O ' ' A' ' 29' ' ' THR . 4.5 m -85.18 8.32 18.71 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.165 -0.471 . . . . 70.44 111.15 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -51.09 169.49 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.198 -0.455 . . . . 73.33 110.844 179.944 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 33.1 t30 65.05 154.38 0.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.178 -0.464 . . . . 64.43 110.861 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.99 -20.21 59.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.177 -0.465 . . . . 70.21 111.134 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -56.77 -25.39 55.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.169 -0.469 . . . . 35.31 110.91 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 4.1 m -85.7 -22.12 27.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.182 -0.463 . . . . 74.02 110.905 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.761 HD21 ' HB3' ' A' ' 16' ' ' GLN . 0.2 OUTLIER -62.53 -44.85 95.34 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.124 -0.489 . . . . 72.52 110.916 179.97 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.4 -51.38 63.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.222 -0.444 . . . . 73.13 110.849 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.28 -51.17 68.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.159 -0.473 . . . . 63.32 111.06 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 5.1 mmtt -59.74 -49.48 77.56 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.209 -0.45 . . . . 72.32 110.917 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.461 ' CD2' HD23 ' A' ' 35' ' ' LEU . 0.1 OUTLIER -55.19 -38.74 68.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 72.11 110.964 179.892 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.38 -46.49 88.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 62.43 111.005 179.751 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -70.39 -37.06 74.45 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.173 -0.467 . . . . 75.11 110.925 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 3.2 ttt -68.73 -46.0 70.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.197 -0.456 . . . . 63.43 110.893 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.626 ' HG2' HD11 ' A' ' 48' ' ' LEU . 18.5 mt-30 -57.31 -43.5 83.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.235 -0.439 . . . . 74.45 110.921 179.988 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.6 mmpt? -69.14 -26.73 65.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.213 -0.449 . . . . 71.43 110.86 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -69.99 -36.25 75.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.26 -0.427 . . . . 73.32 110.926 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.561 ' HB3' HD23 ' A' ' 48' ' ' LEU . 6.1 m-85 -80.48 -30.65 37.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.115 -0.493 . . . . 70.43 110.85 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 105.55 -10.55 46.04 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.749 -0.739 . . . . 64.34 112.465 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.626 HD11 ' HG2' ' A' ' 43' ' ' GLN . 0.6 OUTLIER -63.13 140.06 97.62 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.576 0.703 . . . . 64.11 110.938 -179.881 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.75 -51.9 0.36 Allowed 'Trans proline' 0 C--O 1.231 0.169 0 C-N-CA 122.669 2.246 . . . . 74.5 112.325 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.587 HD13 ' HB2' ' A' ' 56' ' ' SER . 0.7 OUTLIER -48.82 108.21 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.238 -0.437 . . . . 71.22 111.146 179.936 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 1.8 t -111.28 159.33 18.04 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.167 -0.47 . . . . 73.25 111.054 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 58.37 17.07 30.71 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.799 -0.715 . . . . 64.24 112.49 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.2 mtp -127.49 161.05 29.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.823 0.344 . . . . 75.23 110.828 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.515 HD23 ' CE2' ' A' ' 12' ' ' TRP . 20.4 tp -154.38 96.81 1.96 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.223 -0.444 . . . . 73.4 110.944 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 177.51 -32.13 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.2 -0.454 . . . . 44.35 110.933 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' SER . . . . . 0.587 ' HB2' HD13 ' A' ' 50' ' ' ILE . 5.0 m -79.51 -100.71 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.162 -0.472 . . . . 75.25 110.795 -179.834 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.0 mmt85 -84.82 -29.4 25.39 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.166 -0.47 . . . . 61.22 110.864 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.517 HG23 HD12 ' A' ' 50' ' ' ILE . 16.3 t -58.84 -44.06 89.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.234 -0.439 . . . . 70.12 111.124 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.416 HD13 ' HA ' ' A' ' 59' ' ' ILE . 3.4 mm -75.51 -31.31 23.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.19 -0.459 . . . . 74.43 111.116 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.94 -44.55 92.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.148 -0.478 . . . . 73.45 110.874 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.428 HD12 ' CZ ' ' A' ' 46' ' ' PHE . 30.3 pt -64.9 -29.89 48.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.196 -0.456 . . . . 74.52 111.117 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 8.1 mmt -65.16 -36.88 85.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.227 -0.442 . . . . 74.01 110.909 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -90.59 -24.59 20.51 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.177 -0.465 . . . . 42.22 110.948 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 2.8 tppt? -84.88 130.76 51.35 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.552 0.692 . . . . 65.34 110.961 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 126.08 12.89 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.657 2.238 . . . . 72.11 112.36 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.42 ' O ' HD23 ' A' ' 156' ' ' LEU . 19.7 ttp180 -122.18 -84.67 0.66 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.191 -0.459 . . . . 71.51 110.883 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -145.96 147.46 31.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.18 -0.464 . . . . 55.3 110.891 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.59 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -98.41 20.85 48.8 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.74 -0.743 . . . . 64.23 112.518 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.516 HG21 ' CD2' ' A' ' 198' ' ' HIS . 0.1 OUTLIER -109.62 130.83 22.35 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.609 0.719 . . . . 74.23 111.165 179.999 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.466 ' HB3' ' O ' ' A' ' 23' ' ' TYR . 54.3 Cg_endo -69.79 159.39 53.56 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.647 2.231 . . . . 63.44 112.367 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -113.52 28.62 8.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.237 -0.438 . . . . 74.45 110.872 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.566 HG21 ' HB3' ' A' ' 23' ' ' TYR . 3.2 m -127.32 129.21 70.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.165 -0.471 . . . . 53.43 111.163 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -131.05 170.45 14.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.156 -0.475 . . . . 73.13 111.139 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -146.59 113.84 6.25 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.244 -0.435 . . . . 73.31 110.967 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 29.6 t80 -51.61 126.4 17.46 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.136 -0.484 . . . . 70.41 110.892 -179.789 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 179.76 100.55 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.097 -0.501 . . . . 74.2 110.833 -179.857 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.9 mp 54.45 23.02 4.19 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.063 -0.517 . . . . 70.34 110.912 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -50.89 160.59 0.78 Allowed Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 121.672 0.749 . . . . 71.24 110.913 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.422 ' HG3' ' HA2' ' A' ' 163' ' ' GLY . 54.0 Cg_endo -69.68 -174.85 0.97 Allowed 'Trans proline' 0 C--N 1.341 0.156 0 C-N-CA 122.74 2.293 . . . . 73.34 112.311 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -78.59 118.35 20.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.239 -0.437 . . . . 74.43 110.851 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 6.1 m 64.73 148.22 0.11 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.741 0.781 . . . . 70.4 110.799 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 -50.64 0.44 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.723 2.282 . . . . 71.11 112.313 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.724 ' HD2' HD13 ' A' ' 237' ' ' LEU . 2.7 mtpt -96.77 164.72 12.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.167 -0.47 . . . . 64.45 110.932 179.877 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' TRP . . . . . 0.699 ' CE3' HG21 ' A' ' 89' ' ' VAL . 40.8 m0 -46.42 110.5 0.28 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.227 -0.442 . . . . 73.31 110.914 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 15.2 t -115.1 1.26 13.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.248 -0.433 . . . . 65.3 111.169 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.4 172.68 3.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.221 -0.445 . . . . 70.34 110.849 -179.837 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.408 ' O ' ' HB3' ' A' ' 123' ' ' HIS . 0.0 OUTLIER -80.4 -30.43 37.77 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.162 -0.472 . . . . 71.12 110.899 179.88 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -159.66 144.83 6.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.449 . . . . 74.14 111.163 179.92 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.699 HG21 ' CE3' ' A' ' 84' ' ' TRP . 12.9 t -127.68 131.92 69.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.252 -0.431 . . . . 72.25 111.15 179.871 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.525 ' C ' ' HB1' ' A' ' 132' ' ' ALA . 22.9 p -115.44 150.51 36.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.222 -0.444 . . . . 71.01 111.165 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 5.7 p90 -130.85 146.41 52.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.191 -0.459 . . . . 70.51 110.931 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 12.6 ttt180 -149.14 137.0 20.54 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.091 -0.504 . . . . 71.25 110.887 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.48 HD11 ' HA ' ' A' ' 106' ' ' ASP . 11.7 mm -75.02 135.25 27.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.153 -0.476 . . . . 72.4 111.157 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.433 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 18.4 t -90.19 -40.51 12.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.189 -0.46 . . . . 60.2 111.105 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 36.2 t -153.94 169.48 23.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.225 -0.443 . . . . 64.24 110.88 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 14.7 p90 -133.07 155.11 49.82 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.111 -0.495 . . . . 72.25 110.954 -179.843 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.9 t -99.43 141.91 31.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.165 -0.471 . . . . 64.11 111.16 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 7.7 ptp85 -52.01 -19.98 2.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.215 -0.448 . . . . 72.14 110.826 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ASP . . . . . 0.408 ' OD2' HD12 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -70.9 -34.77 71.88 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.261 -0.427 . . . . 74.13 110.808 -179.964 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.645 HD22 HG21 ' A' ' 104' ' ' THR . 6.5 mt -136.08 141.14 35.28 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.628 0.728 . . . . 72.52 110.888 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' PRO . . . . . 0.589 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.8 Cg_endo -69.78 151.0 68.84 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.717 2.278 . . . . 73.11 112.316 179.879 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 2.3 t-160 -53.52 -25.38 16.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.222 -0.445 . . . . 74.11 110.864 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.589 HG22 ' HB2' ' A' ' 101' ' ' PRO . 15.1 tt -77.43 -41.16 29.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.217 -0.447 . . . . 74.02 111.12 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' THR . . . . . 0.793 ' O ' HD22 ' A' ' 108' ' ' LEU . 6.6 m -69.32 -39.05 78.44 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.224 -0.444 . . . . 52.11 111.206 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.8 ' O ' HG13 ' A' ' 109' ' ' VAL . 71.7 t -71.21 -45.5 70.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.157 -0.474 . . . . 71.51 111.112 179.922 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.614 ' O ' HG22 ' A' ' 109' ' ' VAL . 53.6 t0 -63.32 -39.86 95.74 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.196 -0.457 . . . . 63.44 110.854 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' ARG . . . . . 0.497 ' HG3' ' N ' ' A' ' 108' ' ' LEU . 0.1 OUTLIER -70.15 -33.57 71.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.232 -0.44 . . . . 75.02 110.891 -179.865 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.793 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -65.17 -48.47 73.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.133 -0.485 . . . . 71.04 110.887 -179.957 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.8 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.2 m -55.15 -42.49 65.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.226 -0.443 . . . . 72.31 111.144 179.842 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.484 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 30.9 t -70.15 -34.71 73.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.13 -0.487 . . . . 72.14 110.869 -179.854 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.462 ' CG ' HD21 ' A' ' 189' ' ' LEU . 0.3 OUTLIER -62.74 -33.43 75.11 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.124 -0.489 . . . . 74.35 110.895 179.93 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -93.51 -42.08 9.43 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.228 -0.442 . . . . 74.32 111.113 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.732 ' CD1' HD12 ' A' ' 196' ' ' LEU . 0.4 OUTLIER -66.1 -34.14 77.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.243 -0.435 . . . . 72.0 110.958 179.984 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 114' ' ' ASN . . . . . 0.4 ' CB ' ' O ' ' A' ' 110' ' ' SER . 22.2 t30 -68.6 -35.42 77.32 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.148 -0.478 . . . . 72.34 110.862 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 115' ' ' MET . . . . . 0.417 ' O ' ' HG2' ' A' ' 119' ' ' GLU . 0.0 OUTLIER -65.19 -34.14 77.67 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.236 -0.438 . . . . 54.12 110.882 179.923 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 14.6 m95 -67.01 -45.37 77.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.193 -0.458 . . . . 75.23 110.876 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' GLY . . . . . 0.413 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -67.96 -36.5 86.41 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.73 -0.747 . . . . 73.32 112.49 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.26 -17.41 53.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.767 0.317 . . . . 72.42 110.948 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.773 ' HB3' HG23 ' A' ' 231' ' ' ILE . 9.7 mm-40 -99.99 13.46 33.89 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.247 -0.433 . . . . 75.24 110.898 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 1.013 HD12 HD12 ' A' ' 122' ' ' LEU . 7.7 pt -149.28 143.69 17.18 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.521 0.677 . . . . 71.34 111.166 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 26.0 0.18 Allowed 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.625 2.216 . . . . 72.21 112.355 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 1.013 HD12 HD12 ' A' ' 120' ' ' ILE . 12.5 mt -78.99 -161.19 0.28 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 73.22 110.903 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.408 ' HB3' ' O ' ' A' ' 87' ' ' LYS . 12.5 t-80 -150.63 121.06 7.37 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.148 -0.478 . . . . 74.12 110.865 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 9.2 m-30 -110.61 147.47 34.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.22 -0.445 . . . . 75.54 110.925 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.424 ' O ' HG22 ' A' ' 90' ' ' THR . 0.0 OUTLIER -131.14 142.07 50.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.455 . . . . 75.14 110.923 -179.946 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.37 160.09 25.51 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.234 -0.439 . . . . 72.22 110.929 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 127' ' ' VAL . . . . . 0.733 HG11 ' HB2' ' A' ' 132' ' ' ALA . 17.8 m -103.29 126.57 57.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.258 -0.428 . . . . 50.13 111.062 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.595 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -146.9 -11.19 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.138 -0.483 . . . . 74.43 111.066 179.966 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 129' ' ' TRP . . . . . 0.595 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -156.78 109.05 2.49 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.203 -0.453 . . . . 71.25 110.95 179.993 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 103.04 -164.93 15.89 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.79 -0.719 . . . . 62.11 112.541 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.97 155.44 18.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.798 0.332 . . . . 63.25 111.122 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 132' ' ' ALA . . . . . 0.733 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -112.46 165.55 12.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.242 -0.436 . . . . 51.34 111.093 179.871 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -76.03 -40.99 52.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.206 -0.452 . . . . 75.41 110.857 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 134' ' ' ILE . . . . . 0.492 HG23 ' O ' ' A' ' 168' ' ' GLY . 3.1 mm -93.93 107.65 19.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.168 -0.469 . . . . 70.51 111.164 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 135' ' ' MET . . . . . 0.433 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 8.1 mmm -99.58 121.55 41.36 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.207 -0.451 . . . . 72.43 110.897 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -106.96 97.15 5.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.252 -0.431 . . . . 70.04 111.125 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -129.85 168.1 21.38 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.728 -0.749 . . . . 63.34 112.466 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 138' ' ' PHE . . . . . 0.591 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 44.4 m-85 -105.25 143.46 33.39 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.808 0.337 . . . . 74.01 110.911 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.591 ' HB2' ' O ' ' A' ' 138' ' ' PHE . . . 168.28 166.27 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.132 -0.486 . . . . 71.21 111.044 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.415 ' HB2' ' HB3' ' A' ' 149' ' ' PHE . 1.5 ptp180 -107.5 174.33 5.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.22 -0.445 . . . . 62.21 110.846 -179.894 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 141' ' ' GLY . . . . . 0.562 ' H ' ' HA ' ' A' ' 149' ' ' PHE . . . -54.4 -17.55 8.49 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.785 -0.721 . . . . 74.24 112.463 -179.911 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 142' ' ' ALA . . . . . 0.558 ' HB2' ' HD2' ' A' ' 149' ' ' PHE . . . -89.17 13.26 13.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.899 0.381 . . . . 75.03 111.115 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 143' ' ' HIS . . . . . 0.433 ' HB3' ' HB1' ' A' ' 139' ' ' ALA . 6.4 p80 -79.71 0.19 31.53 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.217 -0.447 . . . . 71.11 110.858 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 105.49 51.6 0.85 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.725 -0.75 . . . . 45.51 112.447 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -165.76 175.56 8.67 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.788 0.328 . . . . 72.14 110.898 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.93 177.11 0.82 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 51.25 110.9 -179.823 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 64.69 119.31 0.02 OUTLIER Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.71 0.767 . . . . 73.4 110.936 -179.861 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.72 151.3 69.27 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 122.676 2.251 . . . . 74.53 112.38 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 149' ' ' PHE . . . . . 0.562 ' HA ' ' H ' ' A' ' 141' ' ' GLY . 2.0 p90 -53.72 -32.89 53.73 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.246 -0.434 . . . . 63.52 110.894 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 150' ' ' ASP . . . . . 0.519 ' CG ' ' O ' ' A' ' 149' ' ' PHE . 2.8 p30 49.99 15.87 0.2 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.123 -0.49 . . . . 63.11 110.815 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 151' ' ' GLY . . . . . 0.421 ' C ' ' O ' ' A' ' 150' ' ' ASP . . . 36.72 -153.16 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.723 -0.751 . . . . 71.41 112.457 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 143.58 51.42 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.624 2.216 . . . . 75.11 112.354 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 153' ' ' GLY . . . . . 0.445 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 105.11 -132.53 11.14 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.753 -0.737 . . . . 70.32 112.559 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 154' ' ' ASN . . . . . 0.445 ' C ' ' O ' ' A' ' 153' ' ' GLY . 2.1 p30 -34.67 143.39 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.96 0.409 . . . . 73.25 110.8 -179.889 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 155' ' ' THR . . . . . 0.504 HG22 ' CA ' ' A' ' 68' ' ' GLY . 0.2 OUTLIER 67.69 109.58 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.114 -0.494 . . . . 44.41 111.148 -179.991 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 156' ' ' LEU . . . . . 1.028 HD21 HG21 ' A' ' 186' ' ' ILE . 0.8 OUTLIER -88.56 -55.41 3.73 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.253 -0.43 . . . . 75.02 110.928 179.962 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 157' ' ' ALA . . . . . 0.59 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -159.87 148.75 17.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.152 -0.476 . . . . 71.42 111.038 179.81 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 27.3 p-80 -108.25 125.68 51.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.136 -0.484 . . . . 72.02 110.89 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -110.34 166.53 10.91 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.215 -0.448 . . . . 74.42 111.106 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 21.2 m-30 -115.7 147.32 41.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.257 -0.429 . . . . 75.31 110.887 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 161' ' ' ALA . . . . . 0.706 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -79.99 164.28 53.62 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.608 0.718 . . . . 61.04 111.056 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 162' ' ' PRO . . . . . 0.706 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.3 Cg_endo -69.81 71.44 1.54 Allowed 'Trans proline' 0 N--CA 1.465 -0.154 0 C-N-CA 122.742 2.295 . . . . 74.44 112.306 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 163' ' ' GLY . . . . . 0.422 ' HA2' ' HG3' ' A' ' 79' ' ' PRO . . . -127.44 100.31 0.54 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.763 -0.732 . . . . 61.41 112.518 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 66.9 172.35 0.25 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.85 0.357 . . . . 73.1 111.095 -179.85 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -54.35 -37.13 59.13 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.753 -0.737 . . . . 74.03 112.466 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 166' ' ' LEU . . . . . 0.657 HD23 ' O ' ' A' ' 166' ' ' LEU . 4.0 tt -71.26 -19.64 62.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.792 0.33 . . . . 65.12 110.945 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -93.57 144.64 17.21 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.757 -0.735 . . . . 43.43 112.496 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 168' ' ' GLY . . . . . 0.492 ' O ' HG23 ' A' ' 134' ' ' ILE . . . 102.75 13.04 30.85 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.778 -0.725 . . . . 74.31 112.5 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 29.4 m-20 -82.62 167.62 18.11 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.856 0.36 . . . . 63.41 110.86 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -125.75 130.68 51.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.208 -0.451 . . . . 74.21 111.114 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 171' ' ' HIS . . . . . 0.576 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 23.1 m170 -130.66 132.05 45.21 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.286 -0.415 . . . . 72.53 110.887 179.954 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -115.8 139.41 50.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 71.44 110.859 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 48.3 t0 -71.31 99.77 2.01 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.121 -0.49 . . . . 74.11 110.854 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 1.6 pp20? -57.21 -16.99 9.42 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.231 -0.441 . . . . 72.25 110.913 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -76.36 -16.21 59.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.17 -0.468 . . . . 73.32 110.887 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 23.6 mm-40 -84.34 -174.62 5.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.2 -0.455 . . . . 63.2 110.903 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 12.2 mtt85 -116.49 116.26 27.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.189 -0.46 . . . . 63.14 110.828 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 178' ' ' TRP . . . . . 0.405 ' CE3' ' HB ' ' A' ' 186' ' ' ILE . 13.0 m95 -116.95 146.29 43.08 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.135 -0.484 . . . . 72.31 110.854 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 179' ' ' THR . . . . . 0.576 HG21 ' HB3' ' A' ' 182' ' ' SER . 7.4 t -178.93 163.8 1.41 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.25 -0.432 . . . . 74.13 111.14 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -123.49 -68.11 0.89 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.45 . . . . 45.33 110.901 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -66.63 -10.83 55.68 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.829 -0.701 . . . . 62.41 112.475 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 182' ' ' SER . . . . . 0.576 ' HB3' HG21 ' A' ' 179' ' ' THR . 0.3 OUTLIER -97.32 -24.43 15.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.911 0.386 . . . . 64.5 110.842 -179.716 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 183' ' ' SER . . . . . 0.455 ' C ' ' O ' ' A' ' 182' ' ' SER . 2.9 p 33.33 60.99 0.45 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.107 -0.497 . . . . 64.12 110.926 -179.754 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 16.5 tp -116.85 -33.57 4.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.114 -0.494 . . . . 74.2 110.921 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -121.58 -137.4 5.22 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.747 -0.739 . . . . 73.01 112.514 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 186' ' ' ILE . . . . . 1.028 HG21 HD21 ' A' ' 156' ' ' LEU . 6.6 mm -79.47 99.92 3.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.827 0.346 . . . . 73.22 111.165 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 27.1 m120 -50.93 121.98 6.8 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.2 -0.454 . . . . 71.31 110.85 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 188' ' ' PHE . . . . . 0.782 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.6 t80 -53.93 -35.7 61.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.136 -0.484 . . . . 75.45 110.886 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 189' ' ' LEU . . . . . 0.462 HD21 ' CG ' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -67.21 -47.6 70.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.181 -0.463 . . . . 52.02 110.881 -179.958 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 6.2 t80 -69.52 -37.26 77.07 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.165 -0.47 . . . . 74.22 110.944 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 191' ' ' ALA . . . . . 0.563 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -72.65 -35.78 67.84 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.098 -0.501 . . . . 50.03 111.071 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 192' ' ' ALA . . . . . 0.739 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -61.48 -44.59 96.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.247 -0.433 . . . . 52.11 111.107 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 193' ' ' THR . . . . . 0.51 HG21 HG21 ' A' ' 211' ' ' VAL . 17.7 m -58.52 -45.22 89.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.172 -0.467 . . . . 72.43 111.136 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 20.8 t-160 -72.59 -40.11 66.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.181 -0.463 . . . . 71.44 110.838 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -71.02 -47.0 61.16 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.232 -0.44 . . . . 71.01 111.165 179.901 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 196' ' ' LEU . . . . . 0.739 HD23 ' O ' ' A' ' 192' ' ' ALA . 4.5 mm? -64.88 -38.88 92.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.225 -0.443 . . . . 74.51 110.898 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -62.48 -26.69 68.46 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.673 -0.775 . . . . 52.23 112.483 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 198' ' ' HIS . . . . . 0.516 ' CD2' HG21 ' A' ' 69' ' ' VAL . 4.6 m-70 -65.24 -41.47 94.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.864 0.364 . . . . 75.21 110.93 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 199' ' ' SER . . . . . 0.479 ' HG ' ' HZ2' ' A' ' 84' ' ' TRP . 31.9 t -64.57 -22.4 66.96 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.134 -0.485 . . . . 71.13 110.893 -179.782 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 2.4 mt -83.11 -2.55 55.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.059 -0.519 . . . . 64.13 110.865 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 84.09 4.7 88.19 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.715 -0.755 . . . . 50.41 112.501 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 202' ' ' MET . . . . . 0.423 ' CE ' ' HB ' ' A' ' 234' ' ' ILE . 43.8 tpp -65.82 144.61 56.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.836 0.35 . . . . 63.21 110.874 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -106.19 159.09 15.24 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.761 -0.733 . . . . 64.44 112.546 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 27.2 m-70 -58.1 166.12 1.68 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.796 0.332 . . . . 74.32 110.913 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 2.1 t -128.56 149.18 50.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.24 -0.436 . . . . 53.34 110.825 -179.758 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 1.1 m -88.07 -4.28 58.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.081 -0.509 . . . . 72.22 110.843 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 207' ' ' ASP . . . . . 0.429 ' O ' ' CD1' ' A' ' 213' ' ' TYR . 0.1 OUTLIER -71.27 135.51 84.51 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.59 0.709 . . . . 65.11 110.845 -179.962 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.7 -7.7 21.72 Favored 'Trans proline' 0 C--O 1.231 0.148 0 C-N-CA 122.691 2.26 . . . . 74.53 112.352 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 -127.53 24.27 6.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.258 -0.428 . . . . 63.52 110.89 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 210' ' ' ALA . . . . . 0.445 ' O ' ' HB2' ' A' ' 213' ' ' TYR . . . -87.55 145.76 26.08 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.112 -0.495 . . . . 62.23 111.113 179.831 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 211' ' ' VAL . . . . . 0.51 HG21 HG21 ' A' ' 193' ' ' THR . 0.4 OUTLIER -68.44 -24.94 30.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.144 -0.48 . . . . 62.04 111.146 -179.985 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 1.5 mpp? -95.09 9.7 38.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.464 . . . . 75.22 110.885 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 213' ' ' TYR . . . . . 0.445 ' HB2' ' O ' ' A' ' 210' ' ' ALA . 1.8 t80 -55.06 116.75 12.15 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.689 0.757 . . . . 73.43 110.961 -179.884 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.81 -17.98 37.02 Favored 'Trans proline' 0 C--O 1.232 0.208 0 C-N-CA 122.639 2.226 . . . . 63.01 112.353 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -83.93 2.85 36.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.251 -0.431 . . . . 74.24 111.132 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 1.2 t80 64.1 122.78 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.239 -0.437 . . . . 74.14 110.901 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -54.44 117.14 7.31 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.751 -0.738 . . . . 74.22 112.512 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 8.5 m-20 -63.2 161.73 13.14 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.869 0.366 . . . . 64.22 110.893 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . 73.38 167.44 12.96 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.756 -0.735 . . . . 72.24 112.475 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 220' ' ' ASP . . . . . 0.423 ' HA ' ' HD2' ' A' ' 221' ' ' PRO . 0.5 OUTLIER -107.52 101.47 39.62 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 121.559 0.695 . . . . 41.43 110.822 -179.991 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 221' ' ' PRO . . . . . 0.423 ' HD2' ' HA ' ' A' ' 220' ' ' ASP . 54.5 Cg_endo -69.75 131.87 22.16 Favored 'Trans proline' 0 C--O 1.231 0.149 0 C-N-CA 122.664 2.243 . . . . 73.42 112.371 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -70.46 -39.64 74.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.256 -0.429 . . . . 74.21 110.943 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -126.91 -39.85 1.92 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.158 -0.474 . . . . 60.33 110.894 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 64.57 139.26 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.147 -0.479 . . . . 65.01 110.899 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.87 169.32 18.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.096 -0.502 . . . . 64.24 110.914 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 226' ' ' LEU . . . . . 0.754 HD13 ' HG3' ' A' ' 119' ' ' GLU . 0.9 OUTLIER -59.83 150.73 27.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.205 -0.452 . . . . 53.44 110.898 179.935 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 227' ' ' SER . . . . . 0.445 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 9.8 t -85.4 159.12 20.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.173 -0.467 . . . . 74.21 110.866 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -64.24 -67.24 0.45 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.163 -0.472 . . . . 74.54 110.926 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -55.12 -25.68 33.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.164 -0.471 . . . . 72.22 110.935 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 230' ' ' ASP . . . . . 0.62 ' OD2' HD23 ' A' ' 226' ' ' LEU . 9.9 t0 -69.09 -48.47 62.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.184 -0.462 . . . . 74.23 110.814 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 231' ' ' ILE . . . . . 0.773 HG23 ' HB3' ' A' ' 119' ' ' GLU . 10.2 mt -68.22 -42.94 85.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.216 -0.447 . . . . 73.41 111.137 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 35.4 pttt -65.14 -32.25 73.85 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.164 -0.471 . . . . 65.42 110.872 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -62.8 -48.89 77.51 Favored Glycine 0 C--N 1.33 0.225 0 C-N-CA 120.704 -0.76 . . . . 63.43 112.449 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 234' ' ' ILE . . . . . 0.423 ' HB ' ' CE ' ' A' ' 202' ' ' MET . 11.4 tt -73.05 -31.95 37.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.782 0.325 . . . . 71.54 111.095 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -67.69 -32.71 73.55 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.225 -0.443 . . . . 70.33 110.873 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 236' ' ' LYS . . . . . 0.45 ' HE3' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.17 -22.01 59.6 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.187 -0.46 . . . . 51.21 110.907 179.964 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 237' ' ' LEU . . . . . 0.724 HD13 ' HD2' ' A' ' 83' ' ' LYS . 5.7 tt -97.62 -28.2 14.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.264 -0.425 . . . . 75.41 110.957 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 238' ' ' TYR . . . . . 0.488 ' CE2' HD11 ' A' ' 122' ' ' LEU . 4.4 m-85 -92.12 -35.67 13.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.145 -0.48 . . . . 51.24 110.964 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -118.26 -121.78 3.12 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.72 -0.752 . . . . 32.22 112.508 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 5.2 tttm -87.17 120.37 28.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.773 0.321 . . . . 75.42 110.874 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 20.2 mtm180 -51.64 168.85 0.07 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.235 -0.439 . . . . 73.34 110.879 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 10.7 t -137.37 -41.55 0.56 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.231 -0.44 . . . . 62.42 110.863 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 2.3 m120 63.5 81.56 0.2 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.126 -0.488 . . . . 72.13 110.876 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 97.7 p -174.79 33.47 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.219 -0.446 . . . . 62.23 110.896 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 3.0 ttp180 -110.26 179.32 4.13 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.092 -0.504 . . . . 70.43 110.851 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 4.9 ttpt -161.88 48.29 0.19 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.191 -0.459 . . . . 72.11 110.889 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.45 . . . . 74.13 110.905 179.891 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 302' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' -2' ' ' LEU . . . . . . . . . . . . . 2.8 mp . . . . . 0 C--O 1.231 0.123 0 CA-C-O 121.533 0.682 . . . . 73.02 110.939 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' -1' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.74 -48.25 0.76 Allowed 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.644 2.229 . . . . 71.15 112.376 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 2.8 mt 64.28 154.6 0.12 Allowed Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.618 0.723 . . . . 62.13 110.914 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 -170.98 0.43 Allowed 'Trans proline' 0 N--CA 1.466 -0.125 0 C-N-CA 122.676 2.25 . . . . 64.14 112.38 179.85 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 21.3 tt0 -142.25 74.31 1.44 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.231 -0.44 . . . . 60.51 110.94 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -95.13 -23.57 17.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.455 . . . . 74.01 110.894 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.32 -33.91 66.06 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.114 -0.494 . . . . 71.4 111.137 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -56.0 -26.83 49.72 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.728 -0.749 . . . . 60.51 112.461 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -108.95 19.65 29.98 Favored Glycine 0 N--CA 1.453 -0.223 0 C-N-CA 120.734 -0.746 . . . . 54.22 112.449 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -90.16 164.17 14.54 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.797 0.332 . . . . 72.23 110.864 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 69.5 m -91.02 168.63 11.51 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.296 -0.411 . . . . 73.24 110.87 -179.787 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -59.68 -32.02 70.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.174 -0.466 . . . . 50.12 110.868 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.1 pp -60.83 -42.82 98.47 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.124 -0.489 . . . . 72.33 110.926 -179.94 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -62.08 -43.18 99.38 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.213 -0.449 . . . . 72.14 110.923 179.91 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 13.0 t-105 -72.98 -31.34 64.47 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.254 -0.43 . . . . 71.22 110.908 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -60.24 -35.27 75.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.301 -0.409 . . . . 72.51 110.869 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.94 -36.63 84.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.151 -0.477 . . . . 61.24 110.905 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.13 -35.85 69.97 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.257 -0.429 . . . . 54.34 111.112 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.467 ' OE1' HD22 ' A' ' 35' ' ' LEU . 1.5 tt0 -72.49 -42.95 64.32 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.222 -0.444 . . . . 73.12 110.91 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.68 -32.64 74.08 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.201 -0.454 . . . . 72.4 110.938 179.91 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -70.02 -41.87 73.74 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 75.11 110.933 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.705 HD21 ' HG3' ' A' ' 42' ' ' MET . 6.5 mt -71.64 -32.82 68.37 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.131 -0.486 . . . . 72.51 110.841 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.45 ' HE2' ' HA ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -57.04 -37.53 71.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.217 -0.447 . . . . 74.41 110.885 179.918 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.45 ' HA ' ' HE2' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -85.01 -26.62 26.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.201 -0.454 . . . . 74.05 110.869 179.968 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.423 ' HB2' ' HA ' ' A' ' 19' ' ' LEU . 1.5 m-85 -59.53 -38.6 81.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.147 -0.478 . . . . 74.31 110.852 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.57 ' HE2' HD22 ' A' ' 19' ' ' LEU . 2.4 p90 -120.9 43.5 2.76 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.189 -0.46 . . . . 72.55 110.936 -179.868 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.2 mt 62.1 155.06 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.164 -0.471 . . . . 75.43 110.971 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -76.02 89.31 2.99 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.246 -0.434 . . . . 71.41 110.891 -179.909 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 12.4 t0 -96.33 108.89 21.47 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.117 -0.492 . . . . 74.25 110.802 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.66 -17.99 61.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.197 -0.456 . . . . 62.15 110.882 -179.825 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.88 -12.46 60.71 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.109 -0.496 . . . . 74.51 110.907 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.657 HG23 ' HG3' ' A' ' 38' ' ' LYS . 3.7 m -87.26 8.05 25.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.121 -0.491 . . . . 70.44 111.162 -179.935 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.9 mmtp -51.62 159.57 0.75 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.25 -0.432 . . . . 73.33 110.89 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 63.78 158.89 0.08 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.253 -0.43 . . . . 64.43 110.898 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.76 -27.65 60.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.133 -0.485 . . . . 70.21 111.109 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 10.4 m-20 -53.53 -28.39 31.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.236 -0.438 . . . . 35.31 110.889 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.2 m -84.56 -31.33 24.43 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.151 -0.477 . . . . 74.02 110.878 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.598 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 32.5 tp -57.92 -44.29 86.76 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.108 -0.497 . . . . 72.52 110.927 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -57.14 -51.11 70.61 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.127 -0.488 . . . . 73.13 110.858 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.65 -36.33 83.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.172 -0.467 . . . . 63.32 111.153 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.657 ' HG3' HG23 ' A' ' 29' ' ' THR . 0.2 OUTLIER -66.51 -49.07 67.75 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.16 -0.473 . . . . 72.32 110.945 179.945 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.801 HD13 HD23 ' A' ' 54' ' ' LEU . 11.3 mt -54.62 -38.2 66.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.268 -0.424 . . . . 72.11 110.925 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.7 mmmt -59.44 -45.87 90.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.159 -0.473 . . . . 62.43 110.877 179.865 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.404 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 3.3 pt-20 -69.91 -33.78 72.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.203 -0.453 . . . . 75.11 110.9 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.746 ' HE1' HD11 ' A' ' 61' ' ' ILE . 0.3 OUTLIER -68.47 -46.86 68.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.111 -0.495 . . . . 63.43 110.902 179.959 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.559 ' HB3' HG22 ' A' ' 51' ' ' THR . 1.7 mt-30 -57.66 -40.34 79.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.27 -0.423 . . . . 74.45 110.941 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.0 mmpt? -69.82 -25.7 63.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.255 -0.429 . . . . 71.43 110.877 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -70.08 -36.07 74.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.241 -0.436 . . . . 73.32 110.89 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.628 ' CZ ' HD12 ' A' ' 61' ' ' ILE . 28.2 m-85 -80.49 -27.17 37.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.146 -0.479 . . . . 70.43 110.882 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.434 ' HA2' ' HB2' ' A' ' 206' ' ' SER . . . 102.53 -10.3 56.15 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.716 -0.754 . . . . 64.34 112.479 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.549 HD11 ' CG ' ' A' ' 43' ' ' GLN . 0.8 OUTLIER -65.56 140.52 97.57 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.566 0.698 . . . . 64.11 110.899 -179.927 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.665 ' O ' HG23 ' A' ' 51' ' ' THR . 54.7 Cg_endo -69.73 -54.4 0.22 Allowed 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.662 2.241 . . . . 74.5 112.435 179.79 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.558 HD12 ' CG2' ' A' ' 58' ' ' VAL . 0.8 OUTLIER -50.4 108.25 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.189 -0.46 . . . . 71.22 111.166 179.865 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.665 HG23 ' O ' ' A' ' 49' ' ' PRO . 73.6 p -121.96 159.04 27.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.189 -0.46 . . . . 73.25 111.178 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 82.92 -10.69 56.87 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.79 -0.719 . . . . 64.24 112.439 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.421 ' O ' HG21 ' A' ' 58' ' ' VAL . 30.5 mtp -135.22 161.12 36.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.808 0.337 . . . . 75.23 110.842 -179.909 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.801 HD23 HD13 ' A' ' 39' ' ' LEU . 1.4 pp -160.15 129.42 5.09 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.192 -0.458 . . . . 73.4 110.967 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 p30 172.0 -29.04 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.193 -0.458 . . . . 44.35 110.924 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 2.7 m -97.54 -85.38 0.36 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.188 -0.46 . . . . 75.25 110.806 -179.861 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.595 ' O ' HG23 ' A' ' 61' ' ' ILE . 18.6 tpt180 -84.46 -39.34 19.05 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.12 -0.491 . . . . 61.22 110.859 -179.927 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.558 ' CG2' HD12 ' A' ' 50' ' ' ILE . 15.8 t -59.01 -43.94 90.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.261 -0.427 . . . . 70.12 111.064 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -74.38 -31.17 27.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.23 -0.441 . . . . 74.43 111.133 179.898 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.77 -33.06 71.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.465 . . . . 73.45 110.872 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.746 HD11 ' HE1' ' A' ' 42' ' ' MET . 0.6 OUTLIER -69.94 -29.68 41.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.137 -0.483 . . . . 74.52 111.128 -179.956 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 10.8 mtt -68.04 -35.17 77.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.178 -0.465 . . . . 74.01 110.888 179.814 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -86.9 -24.05 24.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.234 -0.439 . . . . 42.22 110.912 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.31 123.26 73.35 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.639 0.733 . . . . 65.34 110.801 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.77 147.2 62.27 Favored 'Trans proline' 0 N--CA 1.465 -0.181 0 C-N-CA 122.693 2.262 . . . . 72.11 112.373 179.879 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.507 ' O ' HD23 ' A' ' 156' ' ' LEU . 0.2 OUTLIER -150.4 -76.34 0.15 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.245 -0.434 . . . . 71.51 110.88 -179.895 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -144.94 153.94 42.06 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.166 -0.47 . . . . 55.3 110.874 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.53 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -103.97 24.07 30.47 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.736 -0.745 . . . . 64.23 112.501 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.622 HG21 ' CD2' ' A' ' 198' ' ' HIS . 0.2 OUTLIER -104.96 136.71 19.13 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 121.65 0.738 . . . . 74.23 111.063 -179.963 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.584 ' HD2' HG12 ' A' ' 69' ' ' VAL . 53.8 Cg_endo -69.71 162.21 42.92 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.683 2.255 . . . . 63.44 112.333 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -128.59 43.03 3.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.206 -0.452 . . . . 74.45 110.842 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -128.98 129.33 68.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.178 -0.464 . . . . 53.43 111.115 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -131.39 170.6 14.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.125 -0.489 . . . . 73.13 111.111 179.874 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -162.7 82.26 0.51 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.189 -0.46 . . . . 73.31 110.914 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 59.32 169.91 0.07 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.109 -0.496 . . . . 70.41 110.888 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -71.59 179.41 3.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.067 -0.515 . . . . 74.2 110.897 -179.834 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -144.78 -71.31 0.27 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.15 -0.477 . . . . 70.34 110.906 179.939 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' PHE . . . . . 0.631 ' H ' ' HD2' ' A' ' 79' ' ' PRO . 2.7 m-85 -115.05 -66.88 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.633 0.73 . . . . 71.24 110.903 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.631 ' HD2' ' H ' ' A' ' 78' ' ' PHE . 53.4 Cg_endo -69.8 159.05 54.8 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.608 2.205 . . . . 73.34 112.331 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 5.1 m120 -102.55 136.44 42.38 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.213 -0.449 . . . . 74.43 110.911 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.4 m 65.8 140.26 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.648 0.737 . . . . 70.4 110.835 -179.845 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 -48.82 0.63 Allowed 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.669 2.246 . . . . 71.11 112.306 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.683 ' CD ' HD13 ' A' ' 237' ' ' LEU . 2.3 mttp -77.72 171.4 15.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.239 -0.437 . . . . 64.45 110.922 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' TRP . . . . . 0.425 ' CD1' ' HA ' ' A' ' 200' ' ' LEU . 75.9 m95 -66.38 134.84 53.39 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.23 -0.441 . . . . 73.31 110.9 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 5.5 t -115.26 1.36 13.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.259 -0.428 . . . . 65.3 111.172 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -74.95 -178.85 3.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.252 -0.431 . . . . 70.34 110.842 -179.881 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 15.2 mttt -103.08 -8.78 20.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.136 -0.484 . . . . 71.12 110.861 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -153.54 144.92 14.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.258 -0.428 . . . . 74.14 111.097 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 97.4 t -123.62 130.34 74.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.171 -0.468 . . . . 72.25 111.118 179.91 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -116.2 156.34 26.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.164 -0.471 . . . . 71.01 111.097 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 4.8 p90 -147.09 146.84 30.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.254 -0.43 . . . . 70.51 110.967 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -151.15 135.56 16.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.1 -0.5 . . . . 71.25 110.832 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.434 HD11 ' HA ' ' A' ' 106' ' ' ASP . 13.7 mm -75.27 131.67 34.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.185 -0.461 . . . . 72.4 111.144 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.407 ' HB ' ' HA3' ' A' ' 137' ' ' GLY . 16.4 t -88.34 -40.21 13.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.462 . . . . 60.2 111.1 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 3.4 t -151.46 169.63 21.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.186 -0.461 . . . . 64.24 110.803 -179.827 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 11.5 p90 -130.16 154.16 47.8 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.124 -0.489 . . . . 72.25 110.909 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 3.4 t -102.3 141.64 34.8 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.099 -0.5 . . . . 64.11 111.109 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 4.8 mmp_? -52.63 -17.95 1.54 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.187 -0.46 . . . . 72.14 110.937 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.88 -36.87 85.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.156 -0.475 . . . . 74.13 110.862 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.418 HD11 ' HA ' ' A' ' 179' ' ' THR . 1.7 mp -143.13 152.11 57.27 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-O 121.617 0.722 . . . . 72.52 110.932 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' PRO . . . . . 0.574 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.9 Cg_endo -69.71 151.03 69.27 Favored 'Trans proline' 0 C--O 1.233 0.226 0 C-N-CA 122.694 2.262 . . . . 73.11 112.38 179.866 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 3.3 t-160 -52.96 -26.59 15.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.251 -0.431 . . . . 74.11 110.91 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.574 HG22 ' HB2' ' A' ' 101' ' ' PRO . 0.0 OUTLIER -76.46 -39.23 33.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.178 -0.464 . . . . 74.02 111.078 -179.999 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 104' ' ' THR . . . . . 0.632 ' O ' HD22 ' A' ' 108' ' ' LEU . 3.0 m -69.47 -39.67 77.56 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.146 -0.479 . . . . 52.11 111.11 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.781 ' O ' HG13 ' A' ' 109' ' ' VAL . 72.4 t -72.74 -46.37 53.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.302 -0.408 . . . . 71.51 111.114 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.658 ' O ' HG22 ' A' ' 109' ' ' VAL . 59.7 t0 -58.45 -45.53 88.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.17 -0.468 . . . . 63.44 110.845 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 12.2 ptm180 -70.39 -34.08 72.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.222 -0.445 . . . . 75.02 110.797 -179.785 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.632 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -60.87 -48.68 80.69 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.234 -0.439 . . . . 71.04 110.97 -179.999 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.781 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.5 m -55.33 -41.47 61.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.152 -0.476 . . . . 72.31 111.11 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.462 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 47.0 t -70.11 -33.35 71.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.15 -0.477 . . . . 72.14 110.81 -179.775 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.431 ' HB3' HD21 ' A' ' 189' ' ' LEU . 0.4 OUTLIER -61.56 -32.92 73.02 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.165 -0.47 . . . . 74.35 110.864 179.952 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.81 -40.15 9.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.246 -0.434 . . . . 74.32 111.134 179.773 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.82 ' CD1' HD12 ' A' ' 196' ' ' LEU . 0.6 OUTLIER -65.1 -33.4 75.94 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.218 -0.446 . . . . 72.0 110.884 -179.945 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -70.45 -42.63 71.26 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.208 -0.451 . . . . 72.34 110.884 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' MET . . . . . 0.482 ' O ' HD11 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -57.5 -34.75 69.4 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.18 -0.464 . . . . 54.12 110.818 179.926 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 14.6 m95 -61.46 -50.12 74.04 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.252 -0.431 . . . . 75.23 110.906 -179.909 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' GLY . . . . . 0.599 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -73.08 -27.48 68.41 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.768 -0.73 . . . . 73.32 112.406 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.2 mmpt? -63.22 -15.18 56.23 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.791 0.329 . . . . 72.42 110.928 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.525 ' HG3' HG21 ' A' ' 231' ' ' ILE . 0.4 OUTLIER -107.57 14.08 26.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.189 -0.46 . . . . 75.24 110.862 -179.985 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.994 HD12 HD12 ' A' ' 122' ' ' LEU . 7.3 pt -147.08 155.64 47.06 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 121.668 0.747 . . . . 71.34 111.101 -180.0 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.76 3.7 2.62 Favored 'Trans proline' 0 C--N 1.342 0.226 0 C-N-CA 122.633 2.222 . . . . 72.21 112.391 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.994 HD12 HD12 ' A' ' 120' ' ' ILE . 4.6 mt -60.59 -155.37 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.232 -0.44 . . . . 73.22 110.981 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 16.9 t-80 -167.81 149.0 5.31 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.266 -0.424 . . . . 74.12 110.86 179.87 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' PHE . . . . . 0.546 ' CD2' HD21 ' A' ' 113' ' ' LEU . 43.9 m-85 -129.41 148.67 51.35 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.223 -0.444 . . . . 75.54 110.841 -179.901 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.421 ' HG2' ' N ' ' A' ' 126' ' ' LYS . 0.4 OUTLIER -126.22 143.19 51.23 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.13 -0.487 . . . . 75.14 110.919 -179.971 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 126' ' ' LYS . . . . . 0.421 ' N ' ' HG2' ' A' ' 125' ' ' ARG . 0.0 OUTLIER -80.7 140.34 35.65 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.201 -0.454 . . . . 72.22 110.875 -179.999 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 127' ' ' VAL . . . . . 0.899 HG11 ' HB2' ' A' ' 132' ' ' ALA . 16.6 m -102.85 129.81 53.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.468 . . . . 50.13 111.082 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.467 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -142.31 -22.61 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.156 -0.475 . . . . 74.43 111.127 179.916 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 129' ' ' TRP . . . . . 0.467 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -139.01 109.18 6.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.146 -0.479 . . . . 71.25 110.88 -179.975 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 108.43 -160.73 13.61 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.711 -0.757 . . . . 62.11 112.466 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -102.0 155.56 18.09 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.795 0.331 . . . . 63.25 111.139 -179.862 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 132' ' ' ALA . . . . . 0.899 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -112.23 165.47 12.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.201 -0.454 . . . . 51.34 111.057 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -71.53 -58.22 3.7 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.176 -0.466 . . . . 75.41 110.842 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 134' ' ' ILE . . . . . 0.418 HG22 ' CD1' ' A' ' 136' ' ' ILE . 16.8 mm -85.11 107.96 16.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.226 -0.443 . . . . 70.51 111.123 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 8.4 mmm -95.29 121.0 36.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.152 -0.477 . . . . 72.43 110.869 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.418 ' CD1' HG22 ' A' ' 134' ' ' ILE . 0.7 OUTLIER -106.9 97.79 6.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.306 -0.407 . . . . 70.04 111.099 -179.997 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 137' ' ' GLY . . . . . 0.407 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -129.36 165.96 21.83 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.725 -0.75 . . . . 63.34 112.533 179.867 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 138' ' ' PHE . . . . . 0.557 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 82.4 m-85 -105.27 141.45 36.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.859 0.362 . . . . 74.01 110.893 -179.846 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.557 ' HB2' ' O ' ' A' ' 138' ' ' PHE . . . 170.24 165.84 0.06 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.119 -0.491 . . . . 71.21 111.092 179.986 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.42 ' HB2' ' HB3' ' A' ' 149' ' ' PHE . 7.2 ptt180 -105.99 174.08 6.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.194 -0.457 . . . . 62.21 110.849 -179.888 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 141' ' ' GLY . . . . . 0.536 ' H ' ' HA ' ' A' ' 149' ' ' PHE . . . -55.71 -16.76 12.44 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.716 -0.754 . . . . 74.24 112.46 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 142' ' ' ALA . . . . . 0.618 ' HB2' ' CD2' ' A' ' 149' ' ' PHE . . . -91.84 13.12 19.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.86 0.362 . . . . 75.03 111.117 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 143' ' ' HIS . . . . . 0.482 ' HB3' ' HB1' ' A' ' 139' ' ' ALA . 4.3 p80 -79.21 -2.07 39.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.199 -0.455 . . . . 71.11 110.86 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 107.92 49.1 0.85 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.751 -0.738 . . . . 45.51 112.523 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -163.59 174.59 11.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.848 0.356 . . . . 72.14 110.802 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 47.1 p -63.9 -179.61 0.42 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.172 -0.467 . . . . 51.25 110.853 -179.781 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 65.34 119.97 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.627 0.727 . . . . 73.4 110.955 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.8 141.41 45.02 Favored 'Trans proline' 0 C--O 1.232 0.186 0 C-N-CA 122.734 2.29 . . . . 74.53 112.328 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 149' ' ' PHE . . . . . 0.618 ' CD2' ' HB2' ' A' ' 142' ' ' ALA . 3.4 p90 -54.23 -40.71 67.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.275 -0.421 . . . . 63.52 110.879 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 150' ' ' ASP . . . . . 0.482 ' CG ' ' O ' ' A' ' 149' ' ' PHE . 2.8 p30 49.16 19.19 0.28 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.106 -0.497 . . . . 63.11 110.891 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 151' ' ' GLY . . . . . 0.423 ' C ' ' O ' ' A' ' 150' ' ' ASP . . . 35.97 -147.53 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.785 -0.721 . . . . 71.41 112.495 -179.942 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.68 145.27 57.09 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.721 2.28 . . . . 75.11 112.325 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 153' ' ' GLY . . . . . 0.456 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 106.45 -138.99 14.67 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.803 -0.713 . . . . 70.32 112.52 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 154' ' ' ASN . . . . . 0.456 ' C ' ' O ' ' A' ' 153' ' ' GLY . 3.7 p30 -33.8 136.05 0.12 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.896 0.379 . . . . 73.25 110.88 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 155' ' ' THR . . . . . 0.417 HG23 ' HA2' ' A' ' 68' ' ' GLY . 0.6 OUTLIER 77.19 115.91 0.06 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.2 -0.455 . . . . 44.41 111.114 -179.964 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 156' ' ' LEU . . . . . 0.993 HD21 HG21 ' A' ' 186' ' ' ILE . 0.6 OUTLIER -94.53 -53.39 3.92 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.209 -0.45 . . . . 75.02 110.894 179.961 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 157' ' ' ALA . . . . . 0.558 ' HB1' ' O ' ' A' ' 171' ' ' HIS . . . -163.97 149.32 10.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.178 -0.464 . . . . 71.42 111.069 179.818 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 29.3 p-80 -109.13 123.6 49.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.256 -0.429 . . . . 72.02 110.903 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -110.54 152.6 26.19 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.248 -0.433 . . . . 74.42 111.067 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -108.01 169.85 8.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.191 -0.459 . . . . 75.31 110.862 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 161' ' ' ALA . . . . . 0.706 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -107.98 164.23 15.23 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-O 121.624 0.726 . . . . 61.04 111.149 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 162' ' ' PRO . . . . . 0.706 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.9 Cg_endo -69.86 90.06 0.53 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.688 2.259 . . . . 74.44 112.315 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 163' ' ' GLY . . . . . 0.415 ' HA2' ' HB3' ' A' ' 79' ' ' PRO . . . -144.43 141.72 10.36 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.779 -0.724 . . . . 61.41 112.514 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 74.3 m 64.79 -81.31 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.82 0.343 . . . . 73.1 111.135 -179.834 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -179.52 -70.19 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.721 -0.752 . . . . 74.03 112.489 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 166' ' ' LEU . . . . . 0.799 HD22 ' C ' ' A' ' 166' ' ' LEU . 0.0 OUTLIER -54.0 -21.57 8.49 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.815 0.341 . . . . 65.12 110.848 -179.9 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 167' ' ' GLY . . . . . 0.727 ' N ' HD22 ' A' ' 166' ' ' LEU . . . -80.38 -173.84 46.91 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.732 -0.747 . . . . 43.43 112.543 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 72.8 22.26 79.18 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.775 -0.726 . . . . 74.31 112.444 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -95.93 -174.21 3.05 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.798 0.333 . . . . 63.41 110.858 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -124.71 131.42 53.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.128 -0.487 . . . . 74.21 111.064 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 171' ' ' HIS . . . . . 0.558 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 18.8 m170 -125.92 132.37 52.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.206 -0.452 . . . . 72.53 110.882 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 -114.35 140.26 48.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.195 -0.457 . . . . 71.44 110.911 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 57.8 t0 -73.43 101.59 3.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.138 -0.483 . . . . 74.11 110.881 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.34 -16.21 13.51 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.16 -0.473 . . . . 72.25 110.876 -179.892 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -79.11 -16.16 57.1 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.123 -0.49 . . . . 73.32 110.796 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 37.8 mm-40 -83.61 -175.88 6.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.262 -0.427 . . . . 63.2 110.922 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 54.4 mtm180 -111.59 116.86 31.52 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.225 -0.443 . . . . 63.14 110.881 -179.937 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 52.1 m95 -116.96 139.89 50.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.203 -0.453 . . . . 72.31 110.959 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 179' ' ' THR . . . . . 0.442 HG21 ' HB3' ' A' ' 182' ' ' SER . 12.7 t -178.11 163.5 1.71 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.236 -0.438 . . . . 74.13 111.142 -179.961 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -125.32 -70.13 0.76 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.29 -0.413 . . . . 45.33 110.946 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -62.83 -13.57 47.67 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.784 -0.722 . . . . 62.41 112.5 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 182' ' ' SER . . . . . 0.442 ' HB3' HG21 ' A' ' 179' ' ' THR . 0.4 OUTLIER -93.58 -24.41 17.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.859 0.361 . . . . 64.5 110.806 -179.677 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 183' ' ' SER . . . . . 0.422 ' C ' ' O ' ' A' ' 182' ' ' SER . 4.5 m 35.67 57.61 0.9 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.127 -0.488 . . . . 64.12 110.824 -179.776 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 184' ' ' LEU . . . . . 0.408 ' O ' HD23 ' A' ' 184' ' ' LEU . 4.2 tt -116.86 -33.62 4.72 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.124 -0.489 . . . . 74.2 110.837 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -117.99 -140.22 6.43 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.809 -0.71 . . . . 73.01 112.528 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 186' ' ' ILE . . . . . 0.993 HG21 HD21 ' A' ' 156' ' ' LEU . 5.5 mm -79.65 98.58 3.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 120.873 0.368 . . . . 73.22 111.149 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -47.09 120.52 3.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.15 -0.477 . . . . 71.31 110.892 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 188' ' ' PHE . . . . . 0.746 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.4 t80 -54.07 -35.41 62.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.137 -0.483 . . . . 75.45 110.902 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 189' ' ' LEU . . . . . 0.593 HD12 ' CD2' ' A' ' 224' ' ' PHE . 0.2 OUTLIER -67.11 -48.0 69.47 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.077 -0.51 . . . . 52.02 110.946 -179.95 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -70.22 -40.23 74.63 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.152 -0.476 . . . . 74.22 110.906 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 191' ' ' ALA . . . . . 0.67 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -70.62 -35.07 72.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.143 -0.48 . . . . 50.03 111.08 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 192' ' ' ALA . . . . . 0.6 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -56.62 -44.62 81.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.246 -0.433 . . . . 52.11 111.114 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 193' ' ' THR . . . . . 0.504 HG21 ' HE1' ' A' ' 224' ' ' PHE . 0.2 OUTLIER -58.47 -42.37 87.34 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.285 -0.416 . . . . 72.43 111.109 -179.931 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 14.5 t-160 -73.36 -42.06 62.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.263 -0.426 . . . . 71.44 110.755 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -72.09 -48.59 42.91 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.299 -0.409 . . . . 71.01 111.132 179.89 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 196' ' ' LEU . . . . . 0.82 HD12 ' CD1' ' A' ' 113' ' ' LEU . 4.4 mm? -65.73 -43.45 88.99 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.218 -0.447 . . . . 74.51 110.965 -179.955 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -57.34 -28.37 59.04 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.68 -0.771 . . . . 52.23 112.527 179.87 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 198' ' ' HIS . . . . . 0.622 ' CD2' HG21 ' A' ' 69' ' ' VAL . 6.1 m-70 -65.87 -32.84 74.58 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.777 0.322 . . . . 75.21 110.88 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -69.77 -20.84 63.47 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.265 -0.425 . . . . 71.13 110.847 -179.802 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 200' ' ' LEU . . . . . 0.425 ' HA ' ' CD1' ' A' ' 84' ' ' TRP . 0.3 OUTLIER -89.78 5.56 45.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.139 -0.482 . . . . 64.13 110.916 -179.98 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 83.6 -7.52 68.82 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.704 -0.76 . . . . 50.41 112.577 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 202' ' ' MET . . . . . . . . . . . . . 45.4 tpp -55.27 135.24 49.99 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.797 0.332 . . . . 63.21 110.853 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -113.53 158.94 13.97 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.75 -0.738 . . . . 64.44 112.465 -179.958 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 204' ' ' HIS . . . . . 0.404 ' HA ' ' HG3' ' A' ' 212' ' ' MET . 11.2 m170 -55.15 150.76 10.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.793 0.33 . . . . 74.32 110.86 -179.92 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -117.51 162.57 17.76 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.149 -0.478 . . . . 53.34 110.84 -179.751 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 206' ' ' SER . . . . . 0.434 ' HB2' ' HA2' ' A' ' 47' ' ' GLY . 2.0 p -88.36 -4.0 58.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.089 -0.505 . . . . 72.22 110.879 -179.803 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -70.89 134.89 85.58 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.645 0.736 . . . . 65.11 110.825 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.85 -6.1 17.85 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.631 2.22 . . . . 74.53 112.362 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 -126.65 33.42 4.97 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.217 -0.447 . . . . 63.52 110.902 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 210' ' ' ALA . . . . . 0.454 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.28 145.77 26.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.148 -0.478 . . . . 62.23 111.063 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -73.31 -25.91 21.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.222 -0.445 . . . . 62.04 111.122 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 212' ' ' MET . . . . . 0.404 ' HG3' ' HA ' ' A' ' 204' ' ' HIS . 0.0 OUTLIER -99.68 8.7 44.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.222 -0.444 . . . . 75.22 110.849 179.908 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 213' ' ' TYR . . . . . 0.449 ' CD1' ' HD2' ' A' ' 214' ' ' PRO . 0.3 OUTLIER -55.31 128.13 66.21 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.679 0.752 . . . . 73.43 110.955 -179.927 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 214' ' ' PRO . . . . . 0.449 ' HD2' ' CD1' ' A' ' 213' ' ' TYR . 54.2 Cg_endo -69.72 -18.54 37.13 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.738 2.292 . . . . 63.01 112.417 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 2.2 p -84.38 48.3 1.48 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.153 -0.476 . . . . 74.24 111.146 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -94.96 122.6 37.77 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.235 -0.439 . . . . 74.14 110.959 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . 177.32 -39.59 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.747 -0.739 . . . . 74.22 112.492 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 30.8 m-80 -60.58 -169.17 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.841 0.353 . . . . 64.22 110.915 -179.882 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . -50.93 105.11 0.17 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.784 -0.722 . . . . 72.24 112.478 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 220' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -75.4 153.56 85.89 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.685 0.755 . . . . 41.43 110.819 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.79 151.19 68.82 Favored 'Trans proline' 0 C--N 1.342 0.229 0 C-N-CA 122.655 2.236 . . . . 73.42 112.278 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -81.61 -27.61 34.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 74.21 110.902 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -115.09 -39.41 3.65 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.192 -0.458 . . . . 60.33 110.887 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 224' ' ' PHE . . . . . 0.593 ' CD2' HD12 ' A' ' 189' ' ' LEU . 0.0 OUTLIER 67.28 136.38 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 65.01 110.899 179.979 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.64 159.61 42.15 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.182 -0.463 . . . . 64.24 110.919 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 226' ' ' LEU . . . . . 0.63 ' HB3' HD11 ' A' ' 231' ' ' ILE . 24.6 mt -60.21 149.12 34.05 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.287 -0.415 . . . . 53.44 110.882 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 227' ' ' SER . . . . . 0.454 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 1.0 OUTLIER -86.78 152.25 22.67 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.23 -0.441 . . . . 74.21 110.9 -179.927 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -65.19 -68.31 0.37 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.171 -0.468 . . . . 74.54 110.925 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -55.38 -24.97 32.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.174 -0.466 . . . . 72.22 110.826 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 4.9 t0 -69.51 -49.24 56.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.176 -0.465 . . . . 74.23 110.895 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 231' ' ' ILE . . . . . 0.63 HD11 ' HB3' ' A' ' 226' ' ' LEU . 9.2 mt -68.56 -42.63 83.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.203 -0.453 . . . . 73.41 111.211 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 232' ' ' LYS . . . . . 0.41 ' HG3' ' N ' ' A' ' 233' ' ' GLY . 0.2 OUTLIER -59.7 -32.08 70.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.084 -0.507 . . . . 65.42 110.915 179.844 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 233' ' ' GLY . . . . . 0.41 ' N ' ' HG3' ' A' ' 232' ' ' LYS . . . -69.02 -47.11 56.36 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.717 -0.754 . . . . 63.43 112.546 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 13.5 tt -72.59 -30.64 34.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.81 0.338 . . . . 71.54 111.147 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -66.82 -24.56 66.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.108 -0.496 . . . . 70.33 110.975 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 236' ' ' LYS . . . . . 0.472 ' HE3' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.16 -23.1 59.2 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.174 -0.466 . . . . 51.21 110.918 179.929 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 237' ' ' LEU . . . . . 0.683 HD13 ' CD ' ' A' ' 83' ' ' LYS . 10.5 tt -97.24 -38.41 9.69 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.202 -0.454 . . . . 75.41 110.926 179.869 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 238' ' ' TYR . . . . . . . . . . . . . 62.7 m-85 -92.35 -2.66 56.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 51.24 110.914 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -150.69 -118.17 0.84 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.734 -0.746 . . . . 32.22 112.431 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -139.91 122.71 16.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.829 0.347 . . . . 75.42 110.869 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -179.66 167.7 1.39 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.172 -0.467 . . . . 73.34 110.904 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 12.7 p -171.04 128.63 0.73 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.165 -0.47 . . . . 62.42 110.781 -179.754 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -178.58 -54.79 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.112 -0.495 . . . . 72.13 110.86 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 1.4 p -173.76 127.04 0.39 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.145 -0.479 . . . . 62.23 110.844 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.67 107.83 14.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.165 -0.47 . . . . 70.43 110.821 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 27.1 tttt 56.78 25.14 9.91 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 72.11 110.903 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.215 -0.448 . . . . 74.13 110.849 179.85 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 302' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' -2' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.128 0 CA-C-O 121.577 0.703 . . . . 73.02 110.924 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -1' ' ' PRO . . . . . 0.816 ' HB2' HD13 ' A' ' 0' ' ' LEU . 53.6 Cg_endo -69.72 -50.1 0.5 Allowed 'Trans proline' 0 C--O 1.232 0.222 0 C-N-CA 122.626 2.217 . . . . 71.15 112.367 179.867 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 0' ' ' LEU . . . . . 0.816 HD13 ' HB2' ' A' ' -1' ' ' PRO . 0.0 OUTLIER -144.4 159.47 51.69 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.635 0.731 . . . . 62.13 110.945 179.937 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.453 ' HD2' ' HB2' ' A' ' 0' ' ' LEU . 53.9 Cg_endo -69.8 134.45 27.94 Favored 'Trans proline' 0 C--N 1.341 0.145 0 C-N-CA 122.707 2.271 . . . . 64.14 112.33 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 34.3 tt0 52.09 87.48 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.24 -0.436 . . . . 60.51 110.85 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 50.4 tt0 -95.11 -47.76 6.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.171 -0.468 . . . . 74.01 110.91 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.685 ' HB3' ' HB3' ' A' ' 55' ' ' ASN . . . -67.43 -34.04 76.4 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.132 -0.486 . . . . 71.4 111.147 179.915 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -57.29 -41.44 92.99 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.782 -0.723 . . . . 60.51 112.48 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -101.44 21.65 41.95 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.647 -0.787 . . . . 54.22 112.437 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -101.64 164.32 11.81 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.791 0.329 . . . . 72.23 110.882 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -52.36 151.57 3.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.453 . . . . 73.24 110.837 -179.777 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 24.9 pt-20 -62.97 -31.71 72.89 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.154 -0.475 . . . . 50.12 110.931 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.02 -37.44 87.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.129 -0.487 . . . . 72.33 110.907 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.59 HE21 ' N ' ' A' ' 12' ' ' TRP . 0.0 OUTLIER -69.63 -42.69 73.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.165 -0.47 . . . . 72.14 110.887 179.942 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.59 ' N ' HE21 ' A' ' 11' ' ' GLN . 19.0 t-105 -73.21 -31.36 64.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.211 -0.449 . . . . 71.22 110.958 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 62.5 mt-10 -73.41 -35.47 65.85 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.214 -0.448 . . . . 72.51 110.886 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -63.0 -40.97 99.39 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.139 -0.482 . . . . 61.24 110.939 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.658 ' HB1' ' HE3' ' A' ' 62' ' ' MET . . . -61.78 -41.86 98.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.192 -0.458 . . . . 54.34 111.057 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 39.6 tt0 -66.06 -43.15 88.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 73.12 110.9 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -71.07 -31.48 67.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.173 -0.467 . . . . 72.4 110.893 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -70.22 -35.8 74.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.149 -0.478 . . . . 75.11 110.917 -179.805 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.645 HD13 ' O ' ' A' ' 19' ' ' LEU . 3.2 tm? -67.21 -26.24 66.51 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.162 -0.472 . . . . 72.51 110.921 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.407 ' HG2' ' N ' ' A' ' 21' ' ' ARG . 6.3 ptmt -69.43 -32.64 71.73 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.145 -0.48 . . . . 74.41 110.895 179.837 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.407 ' N ' ' HG2' ' A' ' 20' ' ' LYS . 5.3 ptp180 -86.75 -27.62 23.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.213 -0.449 . . . . 74.05 110.905 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.95 -24.29 64.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.162 -0.472 . . . . 74.31 110.955 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.55 ' O ' ' HB3' ' A' ' 70' ' ' PRO . 19.2 m-85 -120.46 -76.84 0.58 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.123 -0.489 . . . . 72.55 110.916 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 97.4 mt -150.01 133.9 16.91 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.08 -0.509 . . . . 75.43 110.895 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -84.92 89.37 7.56 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.167 -0.47 . . . . 71.41 110.961 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -125.11 136.26 53.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.097 -0.501 . . . . 74.25 110.827 179.912 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.3 t -79.14 -7.06 57.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.152 -0.476 . . . . 62.15 110.901 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -61.22 -38.76 87.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.138 -0.483 . . . . 74.51 110.891 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.796 HG21 ' HD2' ' A' ' 38' ' ' LYS . 3.1 m -92.29 9.44 33.92 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.17 -0.468 . . . . 70.44 111.099 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 8.3 ttmt -59.33 99.99 0.07 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.213 -0.449 . . . . 73.33 110.884 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -178.28 147.03 0.41 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.192 -0.458 . . . . 64.43 110.894 179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.97 -38.54 61.66 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.241 -0.436 . . . . 70.21 111.135 179.817 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -72.13 -26.18 62.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.216 -0.447 . . . . 35.31 110.892 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -66.5 -21.01 66.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.199 -0.455 . . . . 74.02 110.925 -179.868 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.436 ' O ' HD13 ' A' ' 39' ' ' LEU . 0.8 OUTLIER -59.99 -37.13 78.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.067 -0.515 . . . . 72.52 110.953 179.914 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -64.25 -51.34 64.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.21 -0.45 . . . . 73.13 110.886 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.82 -47.85 81.63 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.101 -0.5 . . . . 63.32 111.064 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.796 ' HD2' HG21 ' A' ' 29' ' ' THR . 2.4 tttp -60.17 -38.62 83.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.281 -0.418 . . . . 72.32 110.931 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.7 HD21 ' HB2' ' A' ' 54' ' ' LEU . 0.9 OUTLIER -54.6 -36.68 64.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.208 -0.451 . . . . 72.11 110.911 179.902 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.1 ttpp -58.89 -45.72 89.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.183 -0.462 . . . . 62.43 110.914 179.845 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -69.79 -37.34 76.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.22 -0.446 . . . . 75.11 110.908 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.444 ' CE ' HD11 ' A' ' 61' ' ' ILE . 6.7 ttt -68.6 -40.29 80.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.106 -0.497 . . . . 63.43 110.907 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.753 ' HG2' HD11 ' A' ' 48' ' ' LEU . 27.1 mt-30 -65.94 -42.36 90.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.241 -0.436 . . . . 74.45 110.889 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.0 mmpt? -63.37 -28.47 70.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.171 -0.468 . . . . 71.43 110.876 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 15.0 t80 -69.8 -36.84 76.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.218 -0.447 . . . . 73.32 110.915 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.59 ' CZ ' HD12 ' A' ' 61' ' ' ILE . 10.2 m-85 -81.2 -35.24 31.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.165 -0.471 . . . . 70.43 110.907 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 102.79 -6.11 51.6 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.733 -0.746 . . . . 64.34 112.465 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.753 HD11 ' HG2' ' A' ' 43' ' ' GLN . 0.6 OUTLIER -59.71 143.13 87.3 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.593 0.711 . . . . 64.11 110.962 -179.932 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.66 -53.92 0.25 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.712 2.275 . . . . 74.5 112.358 179.894 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.71 HD13 ' OG ' ' A' ' 56' ' ' SER . 0.7 OUTLIER -51.58 108.09 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.146 -0.479 . . . . 71.22 111.157 179.939 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -109.61 160.63 16.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.257 -0.429 . . . . 73.25 111.128 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 57.67 18.51 31.61 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.815 -0.707 . . . . 64.24 112.483 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 10.1 mtt -124.76 161.14 27.07 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.753 0.311 . . . . 75.23 110.885 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.7 ' HB2' HD21 ' A' ' 39' ' ' LEU . 20.1 tp -157.87 96.5 1.49 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.186 -0.461 . . . . 73.4 110.855 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.685 ' HB3' ' HB3' ' A' ' 4' ' ' ALA . 0.7 OUTLIER 174.77 -29.06 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.192 -0.458 . . . . 44.35 110.87 179.892 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 56' ' ' SER . . . . . 0.71 ' OG ' HD13 ' A' ' 50' ' ' ILE . 2.5 p -85.08 -99.63 0.06 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.155 -0.475 . . . . 75.25 110.876 -179.83 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -84.84 -30.5 24.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.139 -0.482 . . . . 61.22 110.866 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.44 HG23 HD12 ' A' ' 50' ' ' ILE . 41.9 t -59.33 -43.75 90.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.193 -0.458 . . . . 70.12 111.144 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.414 HG13 ' HA ' ' A' ' 55' ' ' ASN . 2.9 mm -75.05 -31.33 24.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.172 -0.467 . . . . 74.43 111.1 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -66.1 -44.21 85.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.165 -0.471 . . . . 73.45 110.869 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.59 HD12 ' CZ ' ' A' ' 46' ' ' PHE . 35.5 pt -66.29 -29.78 47.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.115 -0.493 . . . . 74.52 111.143 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.658 ' HE3' ' HB1' ' A' ' 15' ' ' ALA . 1.4 mmm -71.18 -33.2 69.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.166 -0.47 . . . . 74.01 110.885 179.836 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -88.09 -25.66 22.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.199 -0.455 . . . . 42.22 110.896 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.01 137.69 37.47 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.573 0.702 . . . . 65.34 110.897 179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -69.79 113.2 3.3 Favored 'Trans proline' 0 C--O 1.232 0.217 0 C-N-CA 122.66 2.24 . . . . 72.11 112.349 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 4.6 ttm180 -106.87 -85.75 0.5 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.296 -0.411 . . . . 71.51 110.873 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -145.86 156.31 43.47 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.19 -0.459 . . . . 55.3 110.848 -179.929 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.562 ' HA2' HG23 ' A' ' 155' ' ' THR . . . -96.63 16.78 60.43 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.739 -0.743 . . . . 64.23 112.468 -179.924 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.453 HG21 ' CD2' ' A' ' 198' ' ' HIS . 0.0 OUTLIER -111.85 133.15 21.66 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.604 0.716 . . . . 74.23 111.091 -179.927 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.55 ' HB3' ' O ' ' A' ' 23' ' ' TYR . 54.1 Cg_endo -69.7 165.73 29.92 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.66 2.24 . . . . 63.44 112.367 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -120.52 38.51 3.98 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.234 -0.439 . . . . 74.45 110.859 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -139.12 129.59 32.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.167 -0.47 . . . . 53.43 111.102 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -131.03 170.49 14.42 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.145 -0.48 . . . . 73.13 111.06 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -146.69 129.82 16.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.22 -0.446 . . . . 73.31 110.913 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -51.21 167.34 0.08 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.208 -0.451 . . . . 70.41 110.89 -179.872 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.5 m 63.91 158.51 0.08 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.136 -0.484 . . . . 74.2 110.906 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.0 tp 63.36 16.19 9.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.177 -0.465 . . . . 70.34 110.948 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -135.48 160.03 69.38 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-O 121.651 0.739 . . . . 71.24 110.921 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.408 ' HG3' ' HA3' ' A' ' 163' ' ' GLY . 53.5 Cg_endo -69.78 -175.0 1.02 Allowed 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.626 2.217 . . . . 73.34 112.37 -179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 20.9 m120 -98.9 149.0 23.38 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.272 -0.422 . . . . 74.43 110.812 -179.928 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 4.2 m 65.83 121.26 0.02 OUTLIER Pre-proline 0 C--N 1.33 -0.258 0 CA-C-O 121.628 0.728 . . . . 70.4 110.909 -179.824 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.79 -48.31 0.74 Allowed 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.726 2.284 . . . . 71.11 112.332 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.971 ' HD2' HD23 ' A' ' 237' ' ' LEU . 0.3 OUTLIER -89.61 165.34 14.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.237 -0.438 . . . . 64.45 110.855 179.929 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 84' ' ' TRP . . . . . 0.493 ' CD1' ' HA ' ' A' ' 200' ' ' LEU . 24.5 m95 -55.86 123.57 14.69 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.153 -0.476 . . . . 73.31 110.91 179.868 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -115.16 1.35 13.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.243 -0.435 . . . . 65.3 111.109 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -69.63 163.25 25.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.198 -0.455 . . . . 70.34 110.849 -179.874 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.92 -7.21 57.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.153 -0.476 . . . . 71.12 110.837 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -172.76 139.21 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.231 -0.441 . . . . 74.14 111.197 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 13.3 t -122.51 129.59 75.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 72.25 111.091 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.725 HG22 ' HB3' ' A' ' 125' ' ' ARG . 5.0 p -116.99 168.22 10.44 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.169 -0.468 . . . . 71.01 111.144 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.413 ' CD1' ' N ' ' A' ' 91' ' ' TYR . 2.5 p90 -145.26 146.56 31.72 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.259 -0.428 . . . . 70.51 110.909 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.416 ' O ' ' HA ' ' A' ' 135' ' ' MET . 3.4 ttt180 -147.04 132.09 18.23 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.148 -0.478 . . . . 71.25 110.831 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 3.9 mp -74.67 134.97 28.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.155 -0.475 . . . . 72.4 111.113 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.556 HG22 ' CE ' ' A' ' 135' ' ' MET . 11.2 t -93.96 -40.63 11.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.198 -0.456 . . . . 60.2 111.163 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 1.4 t -139.45 164.03 30.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.136 -0.484 . . . . 64.24 110.881 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 11.2 p90 -113.54 152.52 30.12 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.115 -0.493 . . . . 72.25 110.911 -179.859 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.471 ' OG1' HG21 ' A' ' 105' ' ' VAL . 0.2 OUTLIER -82.74 141.02 32.7 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.126 -0.488 . . . . 64.11 111.119 -179.931 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 4.4 ppt_? -74.15 -7.08 51.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.243 -0.435 . . . . 72.14 110.868 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -96.4 -26.47 15.32 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.181 -0.463 . . . . 74.13 110.82 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.567 HD21 ' HA ' ' A' ' 179' ' ' THR . 0.6 OUTLIER -133.84 153.68 80.06 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-O 121.543 0.687 . . . . 72.52 110.954 -179.928 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 101' ' ' PRO . . . . . 0.585 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.9 Cg_endo -69.76 150.89 68.82 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.696 2.264 . . . . 73.11 112.322 179.82 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 16.0 t-160 -52.22 -26.21 11.14 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.138 -0.483 . . . . 74.11 110.825 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.585 HG22 ' HB2' ' A' ' 101' ' ' PRO . 13.9 tt -76.8 -39.2 30.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.199 -0.455 . . . . 74.02 111.122 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 104' ' ' THR . . . . . 0.67 ' O ' HD22 ' A' ' 108' ' ' LEU . 3.4 m -69.46 -38.56 77.81 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.141 -0.481 . . . . 52.11 111.141 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.744 ' O ' HG13 ' A' ' 109' ' ' VAL . 98.7 t -72.7 -45.08 58.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.275 -0.421 . . . . 71.51 111.152 179.88 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.645 ' O ' HG22 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -64.72 -42.42 95.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.21 -0.45 . . . . 63.44 110.823 179.931 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 13.8 ptm180 -70.14 -34.06 72.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.179 -0.464 . . . . 75.02 110.835 -179.842 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.67 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -61.0 -48.84 79.95 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.221 -0.445 . . . . 71.04 110.961 179.95 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.744 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.4 m -55.78 -41.66 66.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.204 -0.453 . . . . 72.31 111.082 179.867 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.471 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 13.5 t -70.1 -34.29 72.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.19 -0.459 . . . . 72.14 110.845 -179.841 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.463 ' CG ' HD21 ' A' ' 189' ' ' LEU . 0.5 OUTLIER -62.44 -33.53 75.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.164 -0.471 . . . . 74.35 110.928 179.912 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -94.68 -40.2 9.93 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.165 -0.47 . . . . 74.32 111.068 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.714 ' CD1' HD12 ' A' ' 196' ' ' LEU . 0.4 OUTLIER -64.86 -33.11 75.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.224 -0.444 . . . . 72.0 110.926 -179.974 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -65.68 -36.4 83.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.164 -0.471 . . . . 72.34 110.887 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' MET . . . . . 0.746 ' O ' HD11 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -64.58 -34.48 78.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.174 -0.466 . . . . 54.12 110.892 179.932 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 116' ' ' TRP . . . . . 0.622 ' O ' ' HG3' ' A' ' 119' ' ' GLU . 6.9 m95 -64.24 -49.48 71.77 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.199 -0.455 . . . . 75.23 110.946 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 117' ' ' GLY . . . . . 0.567 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -74.79 -19.41 79.92 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.802 -0.713 . . . . 73.32 112.45 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 5.6 mtmt -70.53 -14.01 62.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.739 0.304 . . . . 72.42 110.933 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.638 ' OE1' HG23 ' A' ' 120' ' ' ILE . 2.3 pp20? -109.97 12.45 23.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.243 -0.435 . . . . 75.24 110.877 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 1.082 HD12 HD12 ' A' ' 122' ' ' LEU . 4.7 pt -144.25 142.98 20.69 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.64 0.733 . . . . 71.34 111.133 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 16.57 0.21 Allowed 'Trans proline' 0 C--O 1.233 0.268 0 C-N-CA 122.723 2.282 . . . . 72.21 112.33 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 1.082 HD12 HD12 ' A' ' 120' ' ' ILE . 5.2 mt -62.54 -158.07 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.301 -0.409 . . . . 73.22 110.908 -179.981 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 4.5 t-80 -156.47 121.06 4.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.196 -0.456 . . . . 74.12 110.886 179.796 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 11.6 m-30 -109.88 148.69 31.09 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.205 -0.452 . . . . 75.54 110.905 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.725 ' HB3' HG22 ' A' ' 90' ' ' THR . 0.0 OUTLIER -132.03 142.16 49.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.105 -0.498 . . . . 75.14 110.852 -179.878 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 126' ' ' LYS . . . . . 0.457 ' HE3' HG13 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -80.03 149.35 30.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.187 -0.46 . . . . 72.22 110.957 179.909 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 127' ' ' VAL . . . . . 1.025 HG11 ' HB2' ' A' ' 132' ' ' ALA . 26.5 m -103.13 126.14 57.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.195 -0.457 . . . . 50.13 111.087 179.93 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.608 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -142.98 -9.81 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.204 -0.453 . . . . 74.43 111.157 179.885 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 129' ' ' TRP . . . . . 0.608 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -157.31 108.97 2.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.164 -0.471 . . . . 71.25 110.936 179.96 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 109.1 -159.7 13.93 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.727 -0.749 . . . . 62.11 112.512 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 23.7 p -101.96 156.11 17.74 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.821 0.343 . . . . 63.25 111.153 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 132' ' ' ALA . . . . . 1.025 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -111.97 165.32 12.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.26 -0.427 . . . . 51.34 111.06 179.873 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 133' ' ' ASP . . . . . 0.466 ' HB2' HD12 ' A' ' 134' ' ' ILE . 3.0 m-20 -70.03 -65.37 0.73 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.137 -0.483 . . . . 75.41 110.877 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 134' ' ' ILE . . . . . 0.491 HD12 ' N ' ' A' ' 134' ' ' ILE . 3.9 mp -88.71 106.74 17.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.218 -0.446 . . . . 70.51 111.145 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 135' ' ' MET . . . . . 0.556 ' CE ' HG22 ' A' ' 94' ' ' VAL . 0.9 OUTLIER -91.49 128.36 37.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.219 -0.446 . . . . 72.43 110.897 179.838 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.458 ' CD1' HG22 ' A' ' 134' ' ' ILE . 0.5 OUTLIER -106.01 97.6 5.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.302 -0.408 . . . . 70.04 111.1 -179.986 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 137' ' ' GLY . . . . . 0.4 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -130.18 157.73 22.09 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.727 -0.749 . . . . 63.34 112.479 179.932 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 138' ' ' PHE . . . . . 0.616 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 2.7 m-85 -105.12 147.5 27.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.88 0.371 . . . . 74.01 110.89 -179.844 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.616 ' HB2' ' O ' ' A' ' 138' ' ' PHE . . . 166.81 166.56 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.196 -0.456 . . . . 71.21 111.102 179.923 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 47.4 mtm180 -104.74 173.06 6.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.205 -0.452 . . . . 62.21 110.867 -179.908 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -55.02 -20.73 21.4 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.793 -0.718 . . . . 74.24 112.46 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -65.42 -13.57 59.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.818 0.342 . . . . 75.03 111.136 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 2.0 p80 -68.65 -11.13 59.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 71.11 110.917 179.916 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 116.06 39.41 0.88 Allowed Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.752 -0.737 . . . . 45.51 112.468 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -117.91 142.84 46.89 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.755 0.312 . . . . 72.14 110.838 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 52.8 p -65.28 153.73 40.24 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 51.25 110.883 -179.759 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 64.88 134.61 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.674 0.75 . . . . 73.4 110.912 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.67 134.62 28.61 Favored 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.7 2.267 . . . . 74.53 112.362 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -69.21 -32.22 71.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.288 -0.414 . . . . 63.52 110.862 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 74.23 -1.45 3.07 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.119 -0.491 . . . . 63.11 110.835 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 151' ' ' GLY . . . . . 0.663 ' O ' 'CA ' ' A' ' 302' ' ' ' CA' . . . 51.04 -111.12 1.16 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.737 -0.744 . . . . 71.41 112.474 179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.8 139.96 41.36 Favored 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.641 2.227 . . . . 75.11 112.378 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 103.5 -154.38 17.96 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.744 -0.741 . . . . 70.32 112.445 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -41.41 153.17 0.05 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.875 0.369 . . . . 73.25 110.864 -179.864 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 155' ' ' THR . . . . . 0.562 HG23 ' HA2' ' A' ' 68' ' ' GLY . 0.2 OUTLIER 77.31 108.07 0.08 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.236 -0.438 . . . . 44.41 111.136 -179.993 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 156' ' ' LEU . . . . . 1.014 HD21 HG21 ' A' ' 186' ' ' ILE . 0.5 OUTLIER -90.83 -53.49 4.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 75.02 110.93 179.953 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 157' ' ' ALA . . . . . 0.544 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -165.44 148.14 7.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.133 -0.485 . . . . 71.42 111.067 179.809 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 20.0 p-80 -105.75 123.8 48.53 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.156 -0.475 . . . . 72.02 110.903 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -111.33 154.04 25.13 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.274 -0.421 . . . . 74.42 111.094 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 17.7 m-85 -106.8 146.99 30.22 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.202 -0.454 . . . . 75.31 110.845 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 161' ' ' ALA . . . . . 0.707 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -78.47 164.51 55.67 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 121.631 0.729 . . . . 61.04 111.015 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 162' ' ' PRO . . . . . 0.707 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.3 Cg_endo -69.77 78.12 1.03 Allowed 'Trans proline' 0 C--N 1.343 0.237 0 C-N-CA 122.734 2.29 . . . . 74.44 112.299 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 163' ' ' GLY . . . . . 0.408 ' HA3' ' HG3' ' A' ' 79' ' ' PRO . . . -137.81 114.62 1.11 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.692 -0.766 . . . . 61.41 112.447 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 66.64 168.39 0.23 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.864 0.364 . . . . 73.1 111.143 -179.875 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -64.64 -48.17 75.69 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.695 -0.764 . . . . 74.03 112.474 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 166' ' ' LEU . . . . . 0.461 ' C ' HD23 ' A' ' 166' ' ' LEU . 10.1 tt -62.7 -40.01 95.81 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.846 0.355 . . . . 65.12 110.916 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -79.35 163.16 48.45 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.739 -0.743 . . . . 43.43 112.454 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 89.88 22.72 35.12 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.686 -0.769 . . . . 74.31 112.457 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -91.98 161.65 14.71 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.769 0.319 . . . . 63.41 110.888 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.38 130.46 55.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.231 -0.441 . . . . 74.21 111.076 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 4.8 m170 -126.61 158.46 36.24 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.198 -0.455 . . . . 72.53 110.826 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 58.8 m-85 -140.93 138.84 34.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.151 -0.477 . . . . 71.44 110.868 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 66.7 t0 -70.39 96.77 1.18 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.155 -0.475 . . . . 74.11 110.884 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 2.2 pp20? -57.87 -16.62 12.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.174 -0.467 . . . . 72.25 110.878 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -79.43 -16.4 56.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.145 -0.48 . . . . 73.32 110.814 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 25.1 mm-40 -79.78 -174.91 4.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.262 -0.426 . . . . 63.2 110.839 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 39.6 mtm180 -111.23 111.17 22.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.128 -0.487 . . . . 63.14 110.874 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 12.5 m95 -117.13 145.03 44.06 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.253 -0.43 . . . . 72.31 110.953 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 179' ' ' THR . . . . . 0.57 HG21 ' HB3' ' A' ' 182' ' ' SER . 7.2 t -178.58 163.79 1.55 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.265 -0.425 . . . . 74.13 111.079 -179.914 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -123.09 -68.21 0.9 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 45.33 110.902 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -66.99 -10.83 57.23 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.761 -0.733 . . . . 62.41 112.479 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 182' ' ' SER . . . . . 0.57 ' HB3' HG21 ' A' ' 179' ' ' THR . 0.3 OUTLIER -97.36 -24.44 15.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.763 0.316 . . . . 64.5 110.802 -179.71 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 183' ' ' SER . . . . . 0.449 ' C ' ' O ' ' A' ' 182' ' ' SER . 1.3 m 32.93 61.69 0.38 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.178 -0.465 . . . . 64.12 110.826 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -116.82 -33.66 4.72 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.196 -0.456 . . . . 74.2 110.928 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -121.66 -135.38 4.74 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.743 -0.742 . . . . 73.01 112.486 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 186' ' ' ILE . . . . . 1.014 HG21 HD21 ' A' ' 156' ' ' LEU . 8.5 mm -79.41 97.58 2.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.784 0.326 . . . . 73.22 111.113 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -50.87 123.46 9.18 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.193 -0.458 . . . . 71.31 110.846 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 188' ' ' PHE . . . . . 0.731 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.5 t80 -54.27 -36.55 63.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.144 -0.48 . . . . 75.45 110.821 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 189' ' ' LEU . . . . . 0.481 HD12 ' CE2' ' A' ' 224' ' ' PHE . 0.0 OUTLIER -67.43 -47.55 69.88 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.189 -0.459 . . . . 52.02 110.922 -179.958 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 40.4 t80 -69.37 -39.28 78.15 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.222 -0.445 . . . . 74.22 110.874 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 191' ' ' ALA . . . . . 0.725 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -71.64 -35.49 70.42 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.122 -0.49 . . . . 50.03 111.091 179.858 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 192' ' ' ALA . . . . . 0.668 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -56.48 -44.91 81.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.214 -0.448 . . . . 52.11 111.103 179.905 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.4 -41.75 90.18 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.2 -0.455 . . . . 72.43 111.193 -179.88 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 18.1 t-160 -72.7 -39.7 66.78 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.195 -0.457 . . . . 71.44 110.843 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -75.02 -48.1 25.77 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.215 -0.448 . . . . 71.01 111.077 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 196' ' ' LEU . . . . . 0.714 HD12 ' CD1' ' A' ' 113' ' ' LEU . 4.5 mm? -62.22 -39.04 91.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.199 -0.455 . . . . 74.51 110.885 -179.892 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -61.24 -26.54 66.18 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.736 -0.745 . . . . 52.23 112.485 179.916 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 198' ' ' HIS . . . . . 0.453 ' CD2' HG21 ' A' ' 69' ' ' VAL . 6.9 m-70 -70.06 -32.21 70.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.831 0.348 . . . . 75.21 110.856 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -71.72 -21.25 61.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.199 -0.455 . . . . 71.13 110.823 -179.754 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 200' ' ' LEU . . . . . 0.493 ' HA ' ' CD1' ' A' ' 84' ' ' TRP . 0.3 OUTLIER -93.08 -2.44 55.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.154 -0.475 . . . . 64.13 110.974 179.988 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 90.55 -9.5 77.41 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.731 -0.747 . . . . 50.41 112.509 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 202' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.91 129.41 26.8 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.82 0.343 . . . . 63.21 110.858 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -101.02 159.37 18.9 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.734 -0.746 . . . . 64.44 112.451 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 17.5 m-70 -55.93 167.38 0.6 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.774 0.321 . . . . 74.32 110.914 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -129.32 154.14 47.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.242 -0.435 . . . . 53.34 110.873 -179.731 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -87.55 -4.64 58.97 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.178 -0.464 . . . . 72.22 110.821 -179.794 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.72 136.99 82.86 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-O 121.614 0.721 . . . . 65.11 110.927 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 -6.33 18.34 Favored 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.688 2.259 . . . . 74.53 112.375 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -128.05 30.11 5.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.23 -0.441 . . . . 63.52 110.887 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 210' ' ' ALA . . . . . 0.444 ' HA ' ' HB2' ' A' ' 227' ' ' SER . . . -87.17 145.44 26.42 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.204 -0.453 . . . . 62.23 111.122 179.84 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -68.22 -28.53 41.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.256 -0.429 . . . . 62.04 111.167 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 11.0 mtp -97.91 10.52 40.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.134 -0.484 . . . . 75.22 110.897 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 213' ' ' TYR . . . . . 0.412 ' HA ' ' HD2' ' A' ' 214' ' ' PRO . 1.9 t80 -55.56 114.35 7.17 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.638 0.732 . . . . 73.43 110.926 -179.891 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 214' ' ' PRO . . . . . 0.412 ' HD2' ' HA ' ' A' ' 213' ' ' TYR . 53.5 Cg_endo -69.78 -18.36 36.96 Favored 'Trans proline' 0 C--O 1.232 0.209 0 C-N-CA 122.687 2.258 . . . . 63.01 112.316 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 215' ' ' THR . . . . . 0.551 HG23 ' CG2' ' A' ' 61' ' ' ILE . 0.2 OUTLIER -84.24 52.29 2.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.23 -0.441 . . . . 74.24 111.068 -179.893 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -68.8 124.34 23.42 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.26 -0.427 . . . . 74.14 110.906 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . 142.01 68.81 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.781 -0.724 . . . . 74.22 112.454 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -158.6 -53.15 0.06 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.862 0.363 . . . . 64.22 110.881 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . -133.57 158.29 23.17 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.738 -0.744 . . . . 72.24 112.459 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 220' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -120.19 101.42 47.06 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.592 0.71 . . . . 41.43 110.829 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.75 129.1 17.01 Favored 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.734 2.289 . . . . 73.42 112.328 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -81.39 -27.88 34.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.209 -0.451 . . . . 74.21 110.943 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 8.6 p-10 -115.15 -39.92 3.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.181 -0.463 . . . . 60.33 110.876 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 224' ' ' PHE . . . . . 0.481 ' CE2' HD12 ' A' ' 189' ' ' LEU . 0.0 OUTLIER 66.45 135.51 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.185 -0.462 . . . . 65.01 110.843 179.947 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -143.4 171.66 13.83 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.21 -0.45 . . . . 64.24 110.905 179.901 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 226' ' ' LEU . . . . . 0.746 HD11 ' O ' ' A' ' 115' ' ' MET . 25.5 mt -74.39 148.3 41.34 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.242 -0.435 . . . . 53.44 110.933 179.93 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 227' ' ' SER . . . . . 0.444 ' HB2' ' HA ' ' A' ' 210' ' ' ALA . 1.3 t -87.47 152.78 21.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.456 . . . . 74.21 110.873 -179.953 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 55.8 mt-30 -65.7 -64.77 0.78 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.137 -0.483 . . . . 74.54 110.928 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -55.85 -26.85 48.8 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 72.22 110.827 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -69.08 -50.06 51.69 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.192 -0.458 . . . . 74.23 110.901 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 231' ' ' ILE . . . . . 0.744 HD11 HD22 ' A' ' 226' ' ' LEU . 2.6 mm -69.93 -43.96 79.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.226 -0.443 . . . . 73.41 111.139 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 3.4 pttt -56.93 -32.69 66.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.168 -0.469 . . . . 65.42 110.847 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 233' ' ' GLY . . . . . 0.441 ' O ' ' HG3' ' A' ' 236' ' ' LYS . . . -65.52 -49.41 60.57 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.723 -0.751 . . . . 63.43 112.484 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 20.5 tt -73.77 -29.95 27.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.712 0.291 . . . . 71.54 111.075 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -62.3 -40.52 96.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.284 -0.417 . . . . 70.33 110.823 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 236' ' ' LYS . . . . . 0.444 ' HE2' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.24 -15.25 61.0 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.252 -0.431 . . . . 51.21 110.895 -179.99 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 237' ' ' LEU . . . . . 0.971 HD23 ' HD2' ' A' ' 83' ' ' LYS . 1.0 OUTLIER -96.57 -35.63 11.02 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.187 -0.46 . . . . 75.41 110.887 179.925 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 238' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -92.41 -35.58 13.6 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.221 -0.445 . . . . 51.24 110.911 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -118.48 -122.24 3.13 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.715 -0.755 . . . . 32.22 112.466 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.56 156.94 46.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.755 0.312 . . . . 75.42 110.894 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 10.5 mtm180 60.07 -169.55 0.15 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.206 -0.452 . . . . 73.34 110.963 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 68.29 12.0 8.58 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.262 -0.426 . . . . 62.42 110.904 -179.787 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 8.4 m120 -49.96 160.88 0.29 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.097 -0.501 . . . . 72.13 110.828 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 78.3 p -142.67 -169.85 3.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.109 -0.496 . . . . 62.23 110.86 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -91.83 -22.72 19.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.131 -0.486 . . . . 70.43 110.85 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 63.28 167.89 0.14 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.153 -0.476 . . . . 72.11 110.886 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.173 -0.467 . . . . 74.13 110.915 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 302' ' ' ' CA' . . . . . 0.663 'CA ' ' O ' ' A' ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' -2' ' ' LEU . . . . . 0.468 HD22 ' CD ' ' A' ' 60' ' ' GLU . 0.3 OUTLIER . . . . . 0 C--O 1.23 0.037 0 CA-C-O 121.649 0.738 . . . . 73.02 110.967 . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' -1' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 -11.74 31.46 Favored 'Trans proline' 0 C--O 1.233 0.229 0 C-N-CA 122.686 2.258 . . . . 71.15 112.349 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 7.9 mp -51.93 160.64 1.1 Allowed Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.561 0.696 . . . . 62.13 110.968 179.945 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.72 -170.91 0.42 Allowed 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.681 2.254 . . . . 64.14 112.369 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -111.59 116.44 30.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.202 -0.454 . . . . 60.51 110.83 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -95.36 -20.24 19.29 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.135 -0.484 . . . . 74.01 110.872 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.623 ' HB3' ' OD1' ' A' ' 55' ' ' ASN . . . -56.35 -33.9 66.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.455 . . . . 71.4 111.168 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -55.7 -32.97 59.06 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.769 -0.729 . . . . 60.51 112.416 -179.954 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -108.95 21.59 27.12 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.755 -0.736 . . . . 54.22 112.518 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 1.6 ptt? -81.27 164.25 22.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.757 0.313 . . . . 72.23 110.93 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.7 m -86.99 168.74 13.06 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.259 -0.428 . . . . 73.24 110.888 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 60.3 tt0 -54.51 -31.86 56.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.107 -0.497 . . . . 50.12 110.892 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 8.2 mt -62.78 -42.82 99.87 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.145 -0.479 . . . . 72.33 110.908 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -63.19 -44.83 94.27 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.213 -0.449 . . . . 72.14 110.961 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.547 ' CH2' HD23 ' A' ' 54' ' ' LEU . 15.3 t-105 -70.82 -32.84 70.03 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.192 -0.458 . . . . 71.22 110.846 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -68.68 -35.46 77.24 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.282 -0.417 . . . . 72.51 110.939 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -62.94 -37.47 87.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.147 -0.479 . . . . 61.24 110.917 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.401 ' O ' ' HE3' ' A' ' 62' ' ' MET . . . -57.25 -40.15 77.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.209 -0.451 . . . . 54.34 111.087 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.561 ' OE1' HD12 ' A' ' 35' ' ' LEU . 1.6 tt0 -70.98 -42.89 69.09 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 73.12 110.955 -179.91 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -67.44 -31.61 71.9 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.182 -0.463 . . . . 72.4 110.865 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 7.4 m-85 -66.53 -41.75 88.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.224 -0.444 . . . . 75.11 110.858 -179.804 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.703 HD13 ' O ' ' A' ' 19' ' ' LEU . 2.1 tm? -71.36 -29.92 65.54 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.106 -0.497 . . . . 72.51 110.908 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.435 ' HE2' ' HA ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -61.44 -39.76 91.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.179 -0.464 . . . . 74.41 110.88 179.85 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.435 ' HA ' ' HE2' ' A' ' 20' ' ' LYS . 6.0 ptp180 -82.56 -27.72 31.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.226 -0.443 . . . . 74.05 110.911 179.957 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.0 m-30 -60.27 -15.87 28.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.189 -0.46 . . . . 74.31 110.897 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.626 ' HB3' HG21 ' A' ' 72' ' ' VAL . 8.4 m-85 -120.52 -72.49 0.69 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.176 -0.465 . . . . 72.55 110.925 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.576 ' HG ' HG23 ' A' ' 72' ' ' VAL . 13.3 mt -160.38 -79.78 0.05 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.133 -0.485 . . . . 75.43 110.965 179.939 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -176.73 89.92 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.136 -0.484 . . . . 71.41 110.922 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -90.28 90.27 8.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.167 -0.47 . . . . 74.25 110.937 179.86 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 26.5 p -85.1 -34.82 22.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.21 -0.45 . . . . 62.15 110.854 -179.766 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -78.14 -22.13 49.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.113 -0.494 . . . . 74.51 110.883 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -88.14 9.12 23.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.136 -0.484 . . . . 70.44 111.114 -179.878 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.0 mttt -83.02 99.95 10.17 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.245 -0.434 . . . . 73.33 110.931 179.869 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -177.18 169.28 2.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.222 -0.445 . . . . 64.43 110.883 179.894 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.02 -32.19 66.91 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.145 -0.479 . . . . 70.21 111.166 179.892 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 15.0 m-80 -84.86 -49.03 8.75 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.469 . . . . 35.31 110.913 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 26.0 p -63.14 -26.45 68.82 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.156 -0.475 . . . . 74.02 110.844 -179.806 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.561 HD12 ' OE1' ' A' ' 16' ' ' GLN . 1.4 tt -58.1 -40.62 81.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.157 -0.474 . . . . 72.52 110.906 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.29 -51.41 63.65 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 73.13 110.817 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -55.3 -42.66 73.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.21 -0.45 . . . . 63.32 111.121 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.475 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.8 OUTLIER -70.38 -48.47 56.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.242 -0.436 . . . . 72.32 110.888 179.937 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.451 HD13 ' HG ' ' A' ' 35' ' ' LEU . 4.3 mp -54.41 -37.29 64.91 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.258 -0.428 . . . . 72.11 110.945 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.6 tmmt? -58.63 -45.55 89.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.181 -0.463 . . . . 62.43 110.898 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.475 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 3.0 pt-20 -60.68 -32.79 71.98 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.225 -0.443 . . . . 75.11 110.849 -179.965 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 9.3 ttt -68.47 -33.72 74.67 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.143 -0.48 . . . . 63.43 110.909 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.66 ' CD ' HD11 ' A' ' 48' ' ' LEU . 2.2 mm100 -61.63 -39.71 92.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.219 -0.446 . . . . 74.45 110.833 -179.888 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.2 mmpt? -71.6 -33.77 69.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.235 -0.439 . . . . 71.43 110.861 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 33.6 t80 -70.77 -40.26 72.75 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.231 -0.441 . . . . 73.32 110.94 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.861 ' CZ ' HD13 ' A' ' 61' ' ' ILE . 2.8 m-85 -81.76 -35.16 29.93 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.09 -0.505 . . . . 70.43 110.838 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 104.62 -10.08 49.05 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.719 -0.753 . . . . 64.34 112.469 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.686 HD23 ' HB3' ' A' ' 46' ' ' PHE . 0.8 OUTLIER -62.37 134.54 94.9 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.661 0.743 . . . . 64.11 110.897 -179.902 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.462 ' O ' HG23 ' A' ' 51' ' ' THR . 53.6 Cg_endo -69.76 -51.43 0.39 Allowed 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.627 2.218 . . . . 74.5 112.374 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.65 HD11 ' HG2' ' A' ' 57' ' ' ARG . 0.8 OUTLIER -49.61 108.44 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.263 -0.426 . . . . 71.22 111.189 179.895 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.462 HG23 ' O ' ' A' ' 49' ' ' PRO . 77.8 p -97.68 154.1 17.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.183 -0.462 . . . . 73.25 111.133 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 57.81 19.32 35.82 Favored Glycine 0 N--CA 1.453 -0.216 0 C-N-CA 120.724 -0.75 . . . . 64.24 112.445 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 12.8 mmt -101.43 161.12 13.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.811 0.338 . . . . 75.23 110.906 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.547 HD23 ' CH2' ' A' ' 12' ' ' TRP . 28.3 tp -172.21 84.66 0.07 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.215 -0.448 . . . . 73.4 110.884 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.623 ' OD1' ' HB3' ' A' ' 4' ' ' ALA . 1.3 t30 175.46 -28.86 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.134 -0.484 . . . . 44.35 110.88 179.949 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 30.9 t -89.42 -103.19 0.09 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.132 -0.486 . . . . 75.25 110.88 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.65 ' HG2' HD11 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -84.84 -25.12 28.28 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.182 -0.463 . . . . 61.22 110.956 179.99 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.474 HG22 HD13 ' A' ' 48' ' ' LEU . 46.1 t -64.05 -42.15 94.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.166 -0.47 . . . . 70.12 111.141 179.972 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.9 mm -75.27 -31.66 24.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.162 -0.472 . . . . 74.43 111.117 179.921 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.468 ' CD ' HD22 ' A' ' -2' ' ' LEU . 29.2 mt-10 -59.69 -44.08 93.79 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.174 -0.466 . . . . 73.45 110.9 179.926 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.861 HD13 ' CZ ' ' A' ' 46' ' ' PHE . 1.4 pp -63.05 -29.48 47.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.142 -0.481 . . . . 74.52 111.164 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.401 ' HE3' ' O ' ' A' ' 15' ' ' ALA . 11.7 mmt -65.08 -36.73 85.24 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.207 -0.451 . . . . 74.01 110.808 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 15.8 pt20 -91.2 -26.25 19.14 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.306 -0.407 . . . . 42.22 110.877 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.16 125.4 70.3 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.548 0.69 . . . . 65.34 110.911 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.64 151.77 69.82 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.677 2.251 . . . . 72.11 112.351 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.14 -74.55 0.17 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.196 -0.457 . . . . 71.51 110.883 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 26.7 t -130.16 141.56 50.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.217 -0.447 . . . . 55.3 110.935 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.595 ' HA2' HG23 ' A' ' 155' ' ' THR . . . -95.16 16.36 61.47 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.794 -0.717 . . . . 64.23 112.467 -179.909 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.641 HG22 ' HD2' ' A' ' 70' ' ' PRO . 0.7 OUTLIER -125.63 145.4 51.26 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.57 0.7 . . . . 74.23 111.094 -179.927 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.641 ' HD2' HG22 ' A' ' 69' ' ' VAL . 53.6 Cg_endo -69.8 -179.85 3.22 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.727 2.285 . . . . 63.44 112.353 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -133.89 22.11 3.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.251 -0.431 . . . . 74.45 110.899 179.904 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.626 HG21 ' HB3' ' A' ' 23' ' ' TYR . 0.0 OUTLIER -128.63 129.59 68.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.258 -0.428 . . . . 53.43 111.123 -179.978 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -130.8 170.62 14.14 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.139 -0.482 . . . . 73.13 111.068 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -136.47 128.58 29.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.234 -0.439 . . . . 73.31 110.859 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -64.51 122.76 17.53 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.156 -0.475 . . . . 70.41 110.952 -179.868 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 179.99 100.45 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.159 -0.473 . . . . 74.2 110.821 -179.825 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 56.02 21.53 5.12 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.15 -0.477 . . . . 70.34 110.891 179.957 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -75.49 160.13 80.24 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.638 0.732 . . . . 71.24 110.939 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.404 ' HG3' ' CA ' ' A' ' 163' ' ' GLY . 54.2 Cg_endo -69.75 -174.95 1.0 Allowed 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.661 2.241 . . . . 73.34 112.325 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -115.07 154.05 29.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.184 -0.462 . . . . 74.43 110.921 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' SER . . . . . 0.409 ' HA ' ' HD2' ' A' ' 82' ' ' PRO . 0.9 OUTLIER 64.44 109.56 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.648 0.737 . . . . 70.4 110.833 -179.864 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.409 ' HD2' ' HA ' ' A' ' 81' ' ' SER . 53.8 Cg_endo -69.75 -49.11 0.59 Allowed 'Trans proline' 0 N--CA 1.465 -0.183 0 C-N-CA 122.696 2.264 . . . . 71.11 112.369 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.829 ' HD2' HD23 ' A' ' 237' ' ' LEU . 0.1 OUTLIER -88.83 150.48 22.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.189 -0.46 . . . . 64.45 110.883 179.925 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 84' ' ' TRP . . . . . 0.41 ' CD1' ' HA ' ' A' ' 200' ' ' LEU . 70.7 m95 -45.69 109.81 0.21 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.194 -0.457 . . . . 73.31 110.953 179.892 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 15.0 t -95.06 -6.65 41.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.261 -0.427 . . . . 65.3 111.17 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.1 m -65.67 177.94 1.13 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.257 -0.429 . . . . 70.34 110.856 -179.786 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 8.8 mmtp -96.26 -12.0 25.17 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.129 -0.487 . . . . 71.12 110.872 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -156.79 142.64 9.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.261 -0.427 . . . . 74.14 111.093 179.924 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 89.9 t -115.69 130.37 70.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.187 -0.461 . . . . 72.25 111.131 179.864 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.412 HG22 HG13 ' A' ' 127' ' ' VAL . 0.0 OUTLIER -115.7 146.83 41.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.193 -0.458 . . . . 71.01 111.212 179.962 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 4.9 p90 -141.54 146.79 36.78 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.289 -0.414 . . . . 70.51 110.974 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 6.2 ttt180 -150.69 139.0 20.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.155 -0.475 . . . . 71.25 110.862 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.422 HD11 ' HA ' ' A' ' 106' ' ' ASP . 14.2 mm -75.13 125.35 34.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.212 -0.449 . . . . 72.4 111.116 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.657 HG22 ' SD ' ' A' ' 135' ' ' MET . 5.7 t -83.0 -40.58 16.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.139 -0.482 . . . . 60.2 111.175 179.881 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -151.0 169.41 21.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.141 -0.482 . . . . 64.24 110.845 -179.882 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 11.1 p90 -129.72 153.2 48.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.125 -0.489 . . . . 72.25 110.902 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.9 t -101.55 141.68 34.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.121 -0.49 . . . . 64.11 111.122 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.66 -17.78 1.47 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.173 -0.467 . . . . 72.14 110.894 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -65.09 -35.47 81.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.185 -0.462 . . . . 74.13 110.813 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.712 HD21 ' HA ' ' A' ' 179' ' ' THR . 1.8 mp -144.71 152.21 51.93 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 121.616 0.722 . . . . 72.52 110.907 -179.962 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' PRO . . . . . 0.568 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.3 Cg_endo -69.78 151.11 68.88 Favored 'Trans proline' 0 C--O 1.231 0.143 0 C-N-CA 122.762 2.308 . . . . 73.11 112.321 179.845 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 3.3 t-160 -52.68 -26.71 14.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.222 -0.444 . . . . 74.11 110.815 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.568 HG22 ' HB2' ' A' ' 101' ' ' PRO . 2.5 tp -76.64 -39.53 32.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.276 -0.42 . . . . 74.02 111.106 -179.939 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 104' ' ' THR . . . . . 0.684 ' O ' HD22 ' A' ' 108' ' ' LEU . 3.3 m -69.24 -39.9 78.2 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.152 -0.476 . . . . 52.11 111.215 179.913 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.768 ' O ' HG13 ' A' ' 109' ' ' VAL . 70.6 t -72.62 -45.87 56.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.165 -0.47 . . . . 71.51 111.098 179.926 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.627 ' O ' HG22 ' A' ' 109' ' ' VAL . 59.7 t0 -58.56 -44.98 89.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.453 . . . . 63.44 110.844 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 14.4 ptm180 -70.2 -34.02 72.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.217 -0.447 . . . . 75.02 110.862 -179.816 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.684 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -61.21 -49.56 76.65 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.133 -0.485 . . . . 71.04 110.901 -179.93 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.768 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.4 m -55.99 -41.99 70.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.144 -0.48 . . . . 72.31 111.142 179.841 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.468 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 37.5 t -70.12 -34.16 72.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.19 -0.459 . . . . 72.14 110.869 -179.865 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.469 ' CG ' HD21 ' A' ' 189' ' ' LEU . 0.3 OUTLIER -62.29 -32.86 73.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.12 -0.491 . . . . 74.35 110.923 179.955 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -95.63 -40.98 9.14 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.232 -0.44 . . . . 74.32 111.06 179.828 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.813 ' CD1' HD12 ' A' ' 196' ' ' LEU . 0.5 OUTLIER -65.86 -33.15 75.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.278 -0.419 . . . . 72.0 110.856 -179.922 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 39.8 t30 -69.61 -39.14 77.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 72.34 110.844 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' MET . . . . . 0.511 ' O ' HD11 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -62.58 -34.78 77.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.165 -0.471 . . . . 54.12 110.964 179.868 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 7.0 m95 -62.41 -51.85 65.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.152 -0.476 . . . . 75.23 110.946 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' GLY . . . . . 0.558 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -73.42 -24.06 75.87 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.726 -0.75 . . . . 73.32 112.478 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 24.9 mtmt -67.75 -13.93 62.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.726 0.298 . . . . 72.42 110.883 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.465 ' HG2' HG13 ' A' ' 231' ' ' ILE . 0.4 OUTLIER -107.51 13.93 26.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.278 -0.419 . . . . 75.24 110.824 -179.996 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.98 HD12 HD12 ' A' ' 122' ' ' LEU . 7.5 pt -144.61 155.96 56.57 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.642 0.734 . . . . 71.34 111.141 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.79 4.68 2.06 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.681 2.254 . . . . 72.21 112.344 179.887 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.98 HD12 HD12 ' A' ' 120' ' ' ILE . 4.9 mt -61.99 -156.36 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 73.22 110.88 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 28.6 t-80 -163.12 138.06 6.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.227 -0.442 . . . . 74.12 110.868 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' PHE . . . . . 0.55 ' CD2' HD21 ' A' ' 113' ' ' LEU . 30.6 m-85 -123.35 141.77 51.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.165 -0.471 . . . . 75.54 110.864 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -121.55 141.54 50.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.141 -0.481 . . . . 75.14 110.838 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 126' ' ' LYS . . . . . 0.587 ' HE3' HG13 ' A' ' 128' ' ' VAL . 0.1 OUTLIER -80.78 146.48 30.95 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.18 -0.464 . . . . 72.22 110.913 179.94 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 127' ' ' VAL . . . . . 1.014 HG11 ' HB2' ' A' ' 132' ' ' ALA . 29.6 m -103.12 126.26 57.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.243 -0.435 . . . . 50.13 111.13 179.868 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.587 HG13 ' HE3' ' A' ' 126' ' ' LYS . 0.0 OUTLIER -141.55 -16.8 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.193 -0.458 . . . . 74.43 111.111 179.925 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 129' ' ' TRP . . . . . 0.531 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -147.21 109.1 4.41 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.199 -0.455 . . . . 71.25 110.949 179.955 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.69 -161.46 13.57 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.734 -0.746 . . . . 62.11 112.461 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.85 156.65 17.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.752 0.311 . . . . 63.25 111.176 -179.883 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 132' ' ' ALA . . . . . 1.014 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -111.22 164.62 12.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.213 -0.449 . . . . 51.34 111.089 179.88 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.53 -57.75 5.32 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.235 -0.439 . . . . 75.41 110.878 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 20.8 mt -82.57 132.86 30.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.222 -0.444 . . . . 70.51 111.138 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 135' ' ' MET . . . . . 0.657 ' SD ' HG22 ' A' ' 94' ' ' VAL . 27.7 mmt -109.31 115.65 30.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.161 -0.472 . . . . 72.43 110.893 179.879 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -106.07 90.51 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.237 -0.438 . . . . 70.04 111.086 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 137' ' ' GLY . . . . . 0.468 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -129.84 167.96 21.43 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.735 -0.745 . . . . 63.34 112.45 179.905 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 138' ' ' PHE . . . . . 0.461 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 2.0 m-85 -105.39 149.62 25.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.869 0.366 . . . . 74.01 110.898 -179.843 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.614 ' HB1' ' CB ' ' A' ' 143' ' ' HIS . . . 175.84 167.23 0.39 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.129 -0.487 . . . . 71.21 111.104 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 72.8 mtt180 -104.14 173.78 6.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.217 -0.447 . . . . 62.21 110.853 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -56.59 -15.79 13.53 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.736 -0.745 . . . . 74.24 112.532 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -99.86 14.57 29.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.722 0.296 . . . . 75.03 111.023 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 143' ' ' HIS . . . . . 0.614 ' CB ' ' HB1' ' A' ' 139' ' ' ALA . 12.0 p80 -68.21 -33.45 74.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.246 -0.434 . . . . 71.11 110.875 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 147.13 47.01 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.808 -0.711 . . . . 45.51 112.475 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -158.49 149.86 20.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.829 0.347 . . . . 72.14 110.859 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 146' ' ' SER . . . . . 0.489 ' O ' ' CB ' ' A' ' 147' ' ' TYR . 37.6 m -63.66 98.39 0.18 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.166 -0.47 . . . . 51.25 110.847 -179.738 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 147' ' ' TYR . . . . . 0.489 ' CB ' ' O ' ' A' ' 146' ' ' SER . 0.2 OUTLIER 161.81 119.93 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.622 0.725 . . . . 73.4 110.939 -179.853 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.81 143.83 51.82 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.677 2.251 . . . . 74.53 112.324 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 149' ' ' PHE . . . . . 0.529 ' O ' ' CG ' ' A' ' 150' ' ' ASP . 0.2 OUTLIER -54.03 -22.73 11.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.133 -0.485 . . . . 63.52 110.845 -179.955 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 150' ' ' ASP . . . . . 0.529 ' CG ' ' O ' ' A' ' 149' ' ' PHE . 2.8 p30 50.12 18.55 0.4 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.227 -0.442 . . . . 63.11 110.818 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 41.17 -159.73 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.703 -0.761 . . . . 71.41 112.495 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 144.51 54.54 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.697 2.265 . . . . 75.11 112.382 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 153' ' ' GLY . . . . . 0.444 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 105.8 -134.33 12.05 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.699 -0.762 . . . . 70.32 112.535 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 154' ' ' ASN . . . . . 0.444 ' C ' ' O ' ' A' ' 153' ' ' GLY . 4.3 p30 -34.27 133.67 0.22 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.885 0.374 . . . . 73.25 110.888 -179.952 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 155' ' ' THR . . . . . 0.595 HG23 ' HA2' ' A' ' 68' ' ' GLY . 1.3 m 80.25 105.35 0.07 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.186 -0.461 . . . . 44.41 111.147 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 156' ' ' LEU . . . . . 0.972 HD21 HG21 ' A' ' 186' ' ' ILE . 0.6 OUTLIER -91.7 -55.53 3.44 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.236 -0.438 . . . . 75.02 110.965 179.895 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 157' ' ' ALA . . . . . 0.585 ' HB1' ' O ' ' A' ' 171' ' ' HIS . . . -158.45 148.4 19.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.186 -0.461 . . . . 71.42 111.161 179.771 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 158' ' ' HIS . . . . . 0.472 ' HB2' HG23 ' A' ' 69' ' ' VAL . 24.2 p-80 -111.24 116.33 30.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.243 -0.435 . . . . 72.02 110.845 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.631 ' O ' HG21 ' A' ' 69' ' ' VAL . . . -110.86 151.46 27.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.228 -0.442 . . . . 74.42 111.114 179.904 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -118.73 161.17 20.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.216 -0.447 . . . . 75.31 110.845 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 161' ' ' ALA . . . . . 0.728 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -93.12 164.75 20.37 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.598 0.714 . . . . 61.04 111.061 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 162' ' ' PRO . . . . . 0.728 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.6 Cg_endo -69.86 84.43 0.67 Allowed 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.671 2.247 . . . . 74.44 112.323 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 163' ' ' GLY . . . . . 0.404 ' CA ' ' HG3' ' A' ' 79' ' ' PRO . . . -115.21 117.1 3.9 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.718 -0.753 . . . . 61.41 112.507 179.998 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 2.5 m 72.68 -69.47 0.19 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.852 0.358 . . . . 73.1 111.162 -179.797 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . 179.08 -61.56 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.729 -0.748 . . . . 74.03 112.439 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 166' ' ' LEU . . . . . 0.804 HD22 ' C ' ' A' ' 166' ' ' LEU . 0.0 OUTLIER -53.91 -21.5 7.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.813 0.34 . . . . 65.12 110.898 -179.9 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 167' ' ' GLY . . . . . 0.717 ' N ' HD22 ' A' ' 166' ' ' LEU . . . -80.45 -171.5 43.68 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.736 -0.745 . . . . 43.43 112.473 179.908 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 72.88 21.11 80.01 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.723 -0.751 . . . . 74.31 112.523 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 76.8 m-20 -93.69 162.3 13.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.847 0.356 . . . . 63.41 110.889 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -113.34 131.35 55.99 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.145 -0.48 . . . . 74.21 111.064 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 171' ' ' HIS . . . . . 0.585 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 25.3 m170 -124.88 137.16 54.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.245 -0.434 . . . . 72.53 110.857 179.962 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 35.7 m-85 -118.73 139.27 51.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.179 -0.464 . . . . 71.44 110.91 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 55.3 t0 -72.24 100.99 2.72 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.16 -0.473 . . . . 74.11 110.857 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 174' ' ' GLU . . . . . 0.415 ' HG2' ' CD1' ' A' ' 138' ' ' PHE . 0.6 OUTLIER -57.86 -16.08 10.58 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.217 -0.447 . . . . 72.25 110.919 -179.879 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -79.32 -16.25 56.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.119 -0.492 . . . . 73.32 110.938 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 36.4 mm-40 -83.24 -179.51 7.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.18 -0.463 . . . . 63.2 110.878 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 1.5 mtt85 -116.26 113.71 23.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.116 -0.493 . . . . 63.14 110.829 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 5.8 m95 -116.64 147.91 41.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.271 -0.422 . . . . 72.31 110.905 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 179' ' ' THR . . . . . 0.712 ' HA ' HD21 ' A' ' 100' ' ' LEU . 9.2 t -178.73 163.56 1.46 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.246 -0.433 . . . . 74.13 111.194 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -121.7 -71.27 0.74 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.201 -0.454 . . . . 45.33 110.864 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -61.0 -14.9 40.67 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.787 -0.72 . . . . 62.41 112.451 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 182' ' ' SER . . . . . 0.611 ' HB3' HG21 ' A' ' 179' ' ' THR . 0.2 OUTLIER -94.89 -24.33 17.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.926 0.394 . . . . 64.5 110.886 -179.717 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 183' ' ' SER . . . . . 0.451 ' C ' ' O ' ' A' ' 182' ' ' SER . 30.8 m 32.78 59.21 0.42 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.144 -0.48 . . . . 64.12 110.821 -179.869 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 1.3 tt -116.73 -33.58 4.77 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.146 -0.479 . . . . 74.2 110.897 179.999 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -117.94 -137.95 5.88 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.697 -0.763 . . . . 73.01 112.531 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 186' ' ' ILE . . . . . 0.972 HG21 HD21 ' A' ' 156' ' ' LEU . 9.4 mm -79.48 97.58 2.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.859 0.361 . . . . 73.22 111.128 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -48.41 119.92 3.33 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.139 -0.482 . . . . 71.31 110.871 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 188' ' ' PHE . . . . . 0.727 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.5 t80 -54.16 -36.0 62.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.179 -0.464 . . . . 75.45 110.837 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 189' ' ' LEU . . . . . 0.469 HD21 ' CG ' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -67.55 -47.85 68.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.144 -0.48 . . . . 52.02 110.901 -179.928 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 54.6 t80 -69.5 -39.11 77.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.195 -0.457 . . . . 74.22 110.909 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 191' ' ' ALA . . . . . 0.666 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -72.52 -34.59 67.71 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.129 -0.487 . . . . 50.03 111.165 179.791 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 192' ' ' ALA . . . . . 0.652 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -56.17 -44.73 79.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.207 -0.451 . . . . 52.11 111.118 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 193' ' ' THR . . . . . 0.578 HG21 HG21 ' A' ' 211' ' ' VAL . 0.3 OUTLIER -57.97 -41.32 82.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.193 -0.458 . . . . 72.43 111.184 -179.958 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -73.02 -46.3 52.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.272 -0.422 . . . . 71.44 110.867 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -68.24 -47.71 67.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.187 -0.461 . . . . 71.01 111.141 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 196' ' ' LEU . . . . . 0.813 HD12 ' CD1' ' A' ' 113' ' ' LEU . 4.4 mm? -64.67 -41.86 95.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.152 -0.476 . . . . 74.51 110.95 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -55.07 -30.93 55.57 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.749 -0.738 . . . . 52.23 112.532 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 198' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 -66.97 -33.48 75.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.684 0.278 . . . . 75.21 110.839 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 5.5 t -68.5 -20.4 64.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.231 -0.44 . . . . 71.13 110.9 -179.778 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 200' ' ' LEU . . . . . 0.41 ' HA ' ' CD1' ' A' ' 84' ' ' TRP . 0.3 OUTLIER -90.57 -2.6 57.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.065 -0.516 . . . . 64.13 110.866 -179.968 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 84.27 8.75 83.12 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.796 -0.716 . . . . 50.41 112.519 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 202' ' ' MET . . . . . 0.455 ' HE1' ' HB ' ' A' ' 234' ' ' ILE . 32.9 tpp -67.54 142.13 56.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.829 0.347 . . . . 63.21 110.877 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -104.7 159.16 16.06 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.715 -0.755 . . . . 64.44 112.487 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 13.7 m-70 -58.58 159.35 6.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.795 0.331 . . . . 74.32 110.855 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 205' ' ' SER . . . . . 0.503 ' OG ' ' HB1' ' A' ' 210' ' ' ALA . 0.0 OUTLIER -121.09 150.05 41.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.251 -0.432 . . . . 53.34 110.817 -179.736 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 4.3 p -87.99 -4.2 58.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.157 -0.474 . . . . 72.22 110.846 -179.812 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.18 138.12 84.48 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.57 0.7 . . . . 65.11 110.879 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.84 -8.13 22.83 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.663 2.242 . . . . 74.53 112.319 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -126.56 29.36 5.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.221 -0.445 . . . . 63.52 110.941 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 210' ' ' ALA . . . . . 0.503 ' HB1' ' OG ' ' A' ' 205' ' ' SER . . . -87.36 145.53 26.28 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.156 -0.474 . . . . 62.23 111.109 179.908 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 211' ' ' VAL . . . . . 0.578 HG21 HG21 ' A' ' 193' ' ' THR . 0.4 OUTLIER -68.1 -28.34 40.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.215 -0.448 . . . . 62.04 111.147 179.954 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 21.0 mmm -96.97 9.89 40.72 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.169 -0.468 . . . . 75.22 110.893 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 213' ' ' TYR . . . . . 0.409 ' HA ' ' HD2' ' A' ' 214' ' ' PRO . 2.0 t80 -55.6 114.99 8.28 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-O 121.718 0.77 . . . . 73.43 110.949 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 214' ' ' PRO . . . . . 0.409 ' HD2' ' HA ' ' A' ' 213' ' ' TYR . 53.2 Cg_endo -69.72 -18.45 37.17 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.675 2.25 . . . . 63.01 112.316 -179.945 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -84.34 51.54 2.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.225 -0.443 . . . . 74.24 111.128 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -71.99 122.84 21.55 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.279 -0.419 . . . . 74.14 110.894 -179.919 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . 167.92 -33.22 0.2 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.735 -0.745 . . . . 74.22 112.463 179.892 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -105.12 127.56 52.96 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.883 0.373 . . . . 64.22 110.951 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . 86.2 125.49 1.75 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.732 -0.747 . . . . 72.24 112.512 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 220' ' ' ASP . . . . . 0.42 ' HA ' ' HD2' ' A' ' 221' ' ' PRO . 0.1 OUTLIER -117.33 101.41 52.86 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.646 0.736 . . . . 41.43 110.879 -179.981 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 221' ' ' PRO . . . . . 0.42 ' HD2' ' HA ' ' A' ' 220' ' ' ASP . 54.2 Cg_endo -69.73 117.56 5.16 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.723 2.282 . . . . 73.42 112.401 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.26 -22.03 42.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.267 -0.424 . . . . 74.21 110.957 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -116.91 -37.75 3.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.444 . . . . 60.33 110.931 -179.971 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 224' ' ' PHE . . . . . 0.443 ' HE1' HG21 ' A' ' 193' ' ' THR . 0.0 OUTLIER 65.88 129.28 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.167 -0.47 . . . . 65.01 110.858 179.993 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -143.54 161.63 37.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.168 -0.469 . . . . 64.24 110.828 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 226' ' ' LEU . . . . . 0.661 HD22 HD11 ' A' ' 231' ' ' ILE . 37.5 mt -66.52 148.26 52.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.193 -0.458 . . . . 53.44 110.895 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 227' ' ' SER . . . . . 0.433 ' HB3' ' HA ' ' A' ' 210' ' ' ALA . 0.0 OUTLIER -87.89 152.84 21.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.189 -0.459 . . . . 74.21 110.837 -179.94 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -65.58 -68.65 0.35 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.12 -0.491 . . . . 74.54 110.9 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 229' ' ' ASP . . . . . 0.415 ' O ' ' HG2' ' A' ' 232' ' ' LYS . 0.4 OUTLIER -56.3 -24.7 45.1 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.223 -0.444 . . . . 72.22 110.897 179.965 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 40.4 t0 -68.38 -49.84 57.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 74.23 110.868 180.0 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 231' ' ' ILE . . . . . 0.661 HD11 HD22 ' A' ' 226' ' ' LEU . 2.8 mm -69.82 -43.15 80.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.225 -0.443 . . . . 73.41 111.085 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 232' ' ' LYS . . . . . 0.415 ' HG2' ' O ' ' A' ' 229' ' ' ASP . 7.9 ptmt -57.58 -31.87 66.59 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.191 -0.459 . . . . 65.42 110.916 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -68.83 -45.54 64.09 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.714 -0.755 . . . . 63.43 112.486 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 234' ' ' ILE . . . . . 0.455 ' HB ' ' HE1' ' A' ' 202' ' ' MET . 5.5 tt -72.86 -34.36 46.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.724 0.297 . . . . 71.54 111.223 179.972 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -66.31 -26.89 67.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.116 -0.493 . . . . 70.33 110.956 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 236' ' ' LYS . . . . . 0.452 ' HE3' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.67 -22.48 58.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.169 -0.468 . . . . 51.21 110.927 179.925 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 237' ' ' LEU . . . . . 0.829 HD23 ' HD2' ' A' ' 83' ' ' LYS . 1.1 tp -97.24 -16.13 20.51 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.166 -0.47 . . . . 75.41 110.908 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 238' ' ' TYR . . . . . 0.649 ' CZ ' HD11 ' A' ' 122' ' ' LEU . 11.6 m-85 -105.39 -35.19 7.59 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.189 -0.459 . . . . 51.24 110.946 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -107.71 -119.71 4.43 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.726 -0.75 . . . . 32.22 112.46 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 9.7 tttm -101.94 128.03 48.53 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.686 0.279 . . . . 75.42 110.922 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -52.03 141.75 17.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.256 -0.429 . . . . 73.34 110.862 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 30.5 p -163.97 27.36 0.08 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.153 -0.476 . . . . 62.42 110.923 -179.799 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -177.15 174.46 1.66 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.143 -0.481 . . . . 72.13 110.888 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -131.79 119.66 21.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.179 -0.464 . . . . 62.23 110.889 -179.842 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 1.5 ttt180 -162.46 126.89 3.16 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.149 -0.478 . . . . 70.43 110.836 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 12.8 mmtp -113.96 82.15 1.65 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.219 -0.446 . . . . 72.11 110.948 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 74.13 110.922 179.888 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 302' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' -2' ' ' LEU . . . . . 0.493 ' N ' ' HD2' ' A' ' -1' ' ' PRO . 4.4 mp . . . . . 0 C--O 1.231 0.094 0 CA-C-O 121.614 0.721 . . . . 73.02 110.976 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -1' ' ' PRO . . . . . 0.493 ' HD2' ' N ' ' A' ' -2' ' ' LEU . 53.4 Cg_endo -69.79 -170.84 0.42 Allowed 'Trans proline' 0 C--O 1.231 0.161 0 C-N-CA 122.647 2.231 . . . . 71.15 112.287 179.879 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 7.3 mp 59.02 72.71 0.78 Allowed Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.575 0.702 . . . . 62.13 110.889 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 -8.74 24.36 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.72 2.28 . . . . 64.14 112.331 179.876 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.4 pm0 -94.08 40.28 1.08 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.203 -0.453 . . . . 60.51 110.888 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -95.39 -23.64 17.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.161 -0.472 . . . . 74.01 110.86 -179.92 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.654 ' HB2' ' O ' ' A' ' 55' ' ' ASN . . . -56.4 -34.04 66.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.162 -0.472 . . . . 71.4 111.1 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -55.83 -26.4 47.36 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.756 -0.735 . . . . 60.51 112.524 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -108.96 21.58 27.12 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.715 -0.755 . . . . 54.22 112.443 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 8.9 ptm -81.03 164.24 22.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.795 0.331 . . . . 72.23 110.909 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 12.6 m -114.1 168.71 9.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.253 -0.43 . . . . 73.24 110.866 -179.829 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -54.41 -32.58 57.59 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.121 -0.49 . . . . 50.12 110.855 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.0 tp -68.44 -38.12 80.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.166 -0.47 . . . . 72.33 110.901 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 66.1 mm-40 -68.13 -44.84 75.18 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.167 -0.469 . . . . 72.14 110.937 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 37.5 t-105 -71.9 -36.98 70.18 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.262 -0.426 . . . . 71.22 110.923 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -72.98 -35.37 66.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.238 -0.437 . . . . 72.51 110.906 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -63.41 -36.78 84.88 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.156 -0.475 . . . . 61.24 110.881 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.618 ' HB1' ' CE ' ' A' ' 62' ' ' MET . . . -62.44 -34.87 77.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.223 -0.444 . . . . 54.34 111.14 179.93 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.44 ' OE1' HD22 ' A' ' 35' ' ' LEU . 2.4 tt0 -66.07 -43.0 88.64 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.155 -0.475 . . . . 73.12 110.95 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -76.81 -34.1 57.94 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.152 -0.477 . . . . 72.4 110.884 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -70.7 -35.91 73.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.15 -0.477 . . . . 75.11 110.911 -179.864 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.631 HD13 ' O ' ' A' ' 19' ' ' LEU . 3.2 tm? -68.31 -26.03 65.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.159 -0.473 . . . . 72.51 110.873 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.56 ' HA ' ' CE1' ' A' ' 23' ' ' TYR . 7.0 ptmt -68.87 -37.11 78.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.178 -0.464 . . . . 74.41 110.86 179.899 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.455 ' N ' ' HG2' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -79.4 -21.83 45.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.255 -0.43 . . . . 74.05 110.88 -179.996 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -55.41 -30.39 60.34 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.235 -0.439 . . . . 74.31 110.827 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.56 ' CE1' ' HA ' ' A' ' 20' ' ' LYS . 44.9 p90 -120.76 -51.26 2.15 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.104 -0.498 . . . . 72.55 110.923 -179.823 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.427 HD23 ' HA ' ' A' ' 24' ' ' LEU . 10.0 mt -164.9 121.83 1.54 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.145 -0.48 . . . . 75.43 110.912 -179.965 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.474 ' HA ' ' HG3' ' A' ' 20' ' ' LYS . 0.4 OUTLIER -61.8 88.78 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.204 -0.453 . . . . 71.41 110.895 -179.971 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -125.5 130.24 51.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.164 -0.471 . . . . 74.25 110.825 179.922 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 13.1 t -82.48 -6.31 59.23 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.168 -0.469 . . . . 62.15 110.812 -179.77 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.43 -11.67 61.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.202 -0.453 . . . . 74.51 110.905 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.576 HG23 ' HG3' ' A' ' 38' ' ' LYS . 6.7 m -81.25 0.77 35.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.156 -0.475 . . . . 70.44 111.107 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 22.7 mmtt -50.57 165.97 0.09 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.264 -0.426 . . . . 73.33 110.894 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 8.2 m120 65.43 151.3 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.192 -0.458 . . . . 64.43 110.912 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.01 -19.48 60.06 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.142 -0.481 . . . . 70.21 111.093 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -51.72 -45.39 63.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.22 -0.446 . . . . 35.31 110.923 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -86.87 -19.81 28.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.179 -0.464 . . . . 74.02 110.872 -179.884 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.626 HD11 HD21 ' A' ' 39' ' ' LEU . 35.1 tp -57.75 -45.34 86.0 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.104 -0.498 . . . . 72.52 110.891 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -56.76 -50.7 71.49 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.146 -0.479 . . . . 73.13 110.933 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.55 -36.59 83.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.202 -0.454 . . . . 63.32 111.089 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.576 ' HG3' HG23 ' A' ' 29' ' ' THR . 0.0 OUTLIER -69.43 -48.62 60.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.254 -0.43 . . . . 72.32 110.935 179.961 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.746 ' CD1' HD23 ' A' ' 54' ' ' LEU . 10.2 mt -54.42 -38.59 66.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.159 -0.473 . . . . 72.11 110.937 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.0 ttmm -58.75 -46.1 88.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.166 -0.47 . . . . 62.43 110.828 179.881 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.403 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 1.6 pt-20 -70.11 -33.35 71.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.221 -0.445 . . . . 75.11 110.842 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.707 ' CE ' HD11 ' A' ' 61' ' ' ILE . 4.2 ttt -68.27 -46.43 70.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.222 -0.445 . . . . 63.43 110.861 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.513 ' CB ' HG22 ' A' ' 51' ' ' THR . 1.7 mt-30 -63.96 -41.77 97.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.254 -0.43 . . . . 74.45 110.911 -179.943 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.445 ' HE3' HG21 ' A' ' 51' ' ' THR . 8.4 mmtt -66.69 -25.44 66.54 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.147 -0.478 . . . . 71.43 110.837 -179.93 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 38.2 t80 -69.66 -37.03 76.55 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.29 -0.414 . . . . 73.32 110.88 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.597 ' CZ ' HD12 ' A' ' 61' ' ' ILE . 11.8 m-85 -81.27 -31.47 33.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.174 -0.466 . . . . 70.43 110.901 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 104.55 -10.1 49.34 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.776 -0.726 . . . . 64.34 112.469 180.0 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.546 HD23 ' HB3' ' A' ' 46' ' ' PHE . 0.5 OUTLIER -61.62 144.13 93.02 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.612 0.72 . . . . 64.11 110.922 -179.923 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.501 ' O ' HG23 ' A' ' 51' ' ' THR . 53.4 Cg_endo -69.72 -54.66 0.21 Allowed 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.66 2.24 . . . . 74.5 112.307 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.545 HD12 ' CG2' ' A' ' 58' ' ' VAL . 0.8 OUTLIER -51.04 108.26 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.248 -0.433 . . . . 71.22 111.132 179.988 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.513 HG22 ' CB ' ' A' ' 43' ' ' GLN . 40.3 p -123.38 157.41 33.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.214 -0.448 . . . . 73.25 111.129 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 84.06 -10.85 59.49 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.742 -0.742 . . . . 64.24 112.491 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 1.2 mtt -135.16 156.81 48.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.895 0.379 . . . . 75.23 110.874 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.746 HD23 ' CD1' ' A' ' 39' ' ' LEU . 1.9 pp -156.99 129.15 7.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.2 -0.455 . . . . 73.4 110.917 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.654 ' O ' ' HB2' ' A' ' 4' ' ' ALA . 0.5 OUTLIER 173.87 -29.33 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.216 -0.447 . . . . 44.35 110.936 179.874 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 26.1 t -94.16 -89.15 0.23 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.116 -0.493 . . . . 75.25 110.859 -179.871 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.599 ' O ' HG23 ' A' ' 61' ' ' ILE . 7.6 tpt180 -84.76 -35.99 22.05 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.118 -0.492 . . . . 61.22 110.919 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.545 ' CG2' HD12 ' A' ' 50' ' ' ILE . 21.8 t -60.26 -41.73 88.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.132 -0.485 . . . . 70.12 111.132 179.941 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.402 HD13 ' HB2' ' A' ' 62' ' ' MET . 0.2 OUTLIER -74.67 -31.01 25.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.192 -0.458 . . . . 74.43 111.133 179.939 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -59.97 -43.79 94.88 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.128 -0.487 . . . . 73.45 110.921 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.707 HD11 ' CE ' ' A' ' 42' ' ' MET . 0.7 OUTLIER -65.92 -29.78 47.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.148 -0.478 . . . . 74.52 111.167 179.893 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.618 ' CE ' ' HB1' ' A' ' 15' ' ' ALA . 3.9 mmm -70.39 -33.75 71.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.133 -0.485 . . . . 74.01 110.889 179.863 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -88.08 -25.88 22.82 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.202 -0.454 . . . . 42.22 110.898 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.1 mtmp? -85.04 151.93 58.03 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.553 0.692 . . . . 65.34 110.927 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' PRO . . . . . 0.545 ' HB2' HD22 ' A' ' 156' ' ' LEU . 53.8 Cg_endo -69.77 143.68 51.57 Favored 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.695 2.264 . . . . 72.11 112.381 179.879 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 25.8 ttp180 -141.36 -85.52 0.18 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.273 -0.421 . . . . 71.51 110.855 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 16.2 p -145.67 143.75 29.99 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.233 -0.439 . . . . 55.3 110.894 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.636 ' HA2' HG23 ' A' ' 155' ' ' THR . . . -89.08 11.87 68.01 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.683 -0.77 . . . . 64.23 112.466 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.493 HG12 ' HD2' ' A' ' 70' ' ' PRO . 0.1 OUTLIER -116.93 141.4 28.25 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.577 0.703 . . . . 74.23 111.139 -179.987 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.493 ' HD2' HG12 ' A' ' 69' ' ' VAL . 53.6 Cg_endo -69.74 178.12 4.87 Favored 'Trans proline' 0 N--CA 1.465 -0.148 0 C-N-CA 122.719 2.28 . . . . 63.44 112.316 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -128.68 42.63 3.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.204 -0.453 . . . . 74.45 110.798 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -153.84 129.94 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.226 -0.443 . . . . 53.43 111.105 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -130.98 170.4 14.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.123 -0.489 . . . . 73.13 111.103 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -178.22 142.9 0.28 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.236 -0.438 . . . . 73.31 110.879 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 63.43 170.17 0.15 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.179 -0.464 . . . . 70.41 110.898 -179.913 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.5 m 65.83 115.52 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.11 -0.495 . . . . 74.2 110.8 -179.82 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -145.92 34.59 1.01 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.108 -0.496 . . . . 70.34 110.891 179.952 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' PHE . . . . . 0.497 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 0.6 OUTLIER -52.4 -59.95 7.44 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.632 0.729 . . . . 71.24 110.869 179.866 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.497 ' HD2' ' N ' ' A' ' 78' ' ' PHE . 53.5 Cg_endo -69.81 144.67 54.51 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.724 2.283 . . . . 73.34 112.303 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 16.7 m-80 -79.0 120.76 24.05 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.175 -0.466 . . . . 74.43 111.007 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 4.6 m 65.98 138.76 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.591 0.71 . . . . 70.4 110.873 -179.806 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 -15.09 36.76 Favored 'Trans proline' 0 C--N 1.341 0.151 0 C-N-CA 122.655 2.236 . . . . 71.11 112.311 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.708 ' HD3' HD22 ' A' ' 237' ' ' LEU . 5.1 mtpt -106.78 155.24 19.91 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.231 -0.441 . . . . 64.45 110.934 179.904 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' TRP . . . . . 0.652 ' CE3' HG21 ' A' ' 89' ' ' VAL . 38.4 m0 -50.11 112.33 0.66 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.21 -0.45 . . . . 73.31 110.938 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -115.37 -8.1 12.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.251 -0.432 . . . . 65.3 111.105 -179.894 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -59.57 176.13 0.29 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.23 -0.441 . . . . 70.34 110.84 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.34 -30.78 25.21 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.075 -0.512 . . . . 71.12 110.832 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -156.79 144.48 10.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.269 -0.423 . . . . 74.14 111.113 179.865 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.652 HG21 ' CE3' ' A' ' 84' ' ' TRP . 21.7 t -129.33 134.53 63.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.14 -0.482 . . . . 72.25 111.116 179.926 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.461 ' C ' ' HB1' ' A' ' 132' ' ' ALA . 22.0 p -115.66 151.84 34.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.213 -0.449 . . . . 71.01 111.137 -179.943 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 4.6 p90 -132.2 146.01 51.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.227 -0.442 . . . . 70.51 110.937 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 9.4 ttt180 -146.61 136.5 23.33 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.088 -0.505 . . . . 71.25 110.828 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.419 HD11 ' HA ' ' A' ' 106' ' ' ASP . 10.4 mm -75.87 134.18 29.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.154 -0.475 . . . . 72.4 111.092 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.45 ' HB ' ' HA3' ' A' ' 137' ' ' GLY . 15.1 t -92.29 -40.37 12.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.174 -0.466 . . . . 60.2 111.196 179.776 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -150.41 169.45 21.41 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.16 -0.473 . . . . 64.24 110.848 -179.863 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 16.7 p90 -132.24 155.25 48.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.201 -0.454 . . . . 72.25 110.926 -179.838 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 2.9 t -99.72 141.89 31.93 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.076 -0.511 . . . . 64.11 111.126 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.4 -18.02 1.45 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.195 -0.457 . . . . 72.14 110.876 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -65.02 -35.95 82.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.183 -0.462 . . . . 74.13 110.839 -180.0 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.493 HD23 HG21 ' A' ' 104' ' ' THR . 1.8 mp -144.24 152.45 54.2 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.554 0.693 . . . . 72.52 110.959 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' PRO . . . . . 0.582 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.2 Cg_endo -69.79 151.07 68.77 Favored 'Trans proline' 0 C--O 1.232 0.216 0 C-N-CA 122.717 2.278 . . . . 73.11 112.32 179.927 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 -51.07 -26.66 6.67 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.173 -0.467 . . . . 74.11 110.901 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.582 HG22 ' HB2' ' A' ' 101' ' ' PRO . 10.5 tp -76.74 -38.45 30.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.181 -0.463 . . . . 74.02 111.101 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 104' ' ' THR . . . . . 0.642 ' O ' HD22 ' A' ' 108' ' ' LEU . 3.2 m -68.86 -39.47 79.85 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.197 -0.456 . . . . 52.11 111.198 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.756 ' O ' HG13 ' A' ' 109' ' ' VAL . 69.9 t -73.0 -45.29 55.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.21 -0.45 . . . . 71.51 111.101 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.662 ' O ' HG22 ' A' ' 109' ' ' VAL . 43.3 t0 -60.39 -44.96 95.16 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.213 -0.449 . . . . 63.44 110.903 179.873 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 11.5 ptm180 -70.15 -33.5 71.88 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.183 -0.462 . . . . 75.02 110.925 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.642 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -60.68 -48.89 79.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.193 -0.458 . . . . 71.04 110.922 -179.984 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.756 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.5 m -55.44 -41.68 63.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.156 -0.475 . . . . 72.31 111.197 179.845 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.465 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 47.7 t -70.11 -33.57 72.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.173 -0.467 . . . . 72.14 110.875 -179.902 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.465 ' HB3' HD21 ' A' ' 189' ' ' LEU . 0.4 OUTLIER -61.96 -33.01 73.5 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.091 -0.504 . . . . 74.35 110.892 179.929 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.29 -40.32 9.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.26 -0.427 . . . . 74.32 111.049 179.88 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 1.016 HD13 HD12 ' A' ' 196' ' ' LEU . 6.4 tp -65.31 -32.54 74.25 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.29 -0.413 . . . . 72.0 110.884 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -65.37 -38.4 89.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.213 -0.449 . . . . 72.34 110.87 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' MET . . . . . 0.641 ' O ' HD11 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -62.24 -34.48 76.58 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.232 -0.44 . . . . 54.12 110.883 179.856 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 7.1 m95 -67.04 -52.41 42.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.223 -0.444 . . . . 75.23 110.863 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -59.65 -37.87 92.93 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.718 -0.753 . . . . 73.32 112.522 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.1 mmpt? -61.34 -17.07 52.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.729 0.3 . . . . 72.42 110.872 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.819 ' HG2' HD13 ' A' ' 226' ' ' LEU . 0.5 OUTLIER -98.99 12.85 34.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.242 -0.436 . . . . 75.24 110.902 179.992 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 1.9 pt -148.28 145.76 21.35 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.711 0.767 . . . . 71.34 111.059 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.84 6.32 1.38 Allowed 'Trans proline' 0 C--N 1.343 0.249 0 C-N-CA 122.678 2.252 . . . . 72.21 112.341 179.889 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.433 ' HA ' HD23 ' A' ' 122' ' ' LEU . 4.1 mt -62.77 -156.95 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.203 -0.453 . . . . 73.22 110.962 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 21.8 t-80 -154.6 123.15 6.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.284 -0.416 . . . . 74.12 110.882 179.882 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 9.2 m-30 -108.23 133.14 52.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.224 -0.444 . . . . 75.54 110.868 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.425 ' O ' HG22 ' A' ' 90' ' ' THR . 0.0 OUTLIER -119.29 141.66 48.78 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.165 -0.47 . . . . 75.14 110.921 -179.915 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.82 160.27 24.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.197 -0.456 . . . . 72.22 110.852 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 127' ' ' VAL . . . . . 0.731 HG11 ' HB2' ' A' ' 132' ' ' ALA . 18.2 m -103.1 126.61 57.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.185 -0.462 . . . . 50.13 111.102 179.858 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.583 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -146.96 -13.35 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.157 -0.474 . . . . 74.43 111.138 179.896 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 129' ' ' TRP . . . . . 0.583 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -153.65 109.05 3.2 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.173 -0.467 . . . . 71.25 110.89 179.919 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 102.45 -165.09 16.66 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.804 -0.712 . . . . 62.11 112.541 179.97 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.99 155.67 18.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.824 0.345 . . . . 63.25 111.093 -179.835 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 132' ' ' ALA . . . . . 0.731 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -112.37 165.7 11.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.213 -0.449 . . . . 51.34 111.06 179.811 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -76.34 -41.67 47.53 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.19 -0.459 . . . . 75.41 110.885 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 134' ' ' ILE . . . . . 0.65 HG23 ' O ' ' A' ' 168' ' ' GLY . 3.9 mm -94.76 107.83 19.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.185 -0.461 . . . . 70.51 111.146 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 135' ' ' MET . . . . . 0.433 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 9.3 mmm -98.59 122.5 41.87 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.152 -0.476 . . . . 72.43 110.929 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -106.28 95.23 3.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.262 -0.426 . . . . 70.04 111.162 179.99 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 137' ' ' GLY . . . . . 0.45 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -132.6 165.93 23.63 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.755 -0.736 . . . . 63.34 112.495 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 138' ' ' PHE . . . . . 0.539 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 2.8 m-85 -107.11 147.07 30.49 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.838 0.351 . . . . 74.01 110.872 -179.844 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.539 ' HB2' ' O ' ' A' ' 138' ' ' PHE . . . 170.96 166.35 0.08 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.166 -0.47 . . . . 71.21 111.131 179.894 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 34.8 mtp180 -105.05 173.57 6.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.183 -0.462 . . . . 62.21 110.87 -179.9 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -53.51 -22.02 15.36 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.742 -0.742 . . . . 74.24 112.455 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -67.48 -10.9 55.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.827 0.346 . . . . 75.03 111.163 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 2.5 p80 -68.81 -11.91 60.94 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 71.11 110.865 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 118.63 39.57 0.71 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.736 -0.745 . . . . 45.51 112.454 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -123.3 141.1 52.33 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.748 0.309 . . . . 72.14 110.872 -179.952 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 3.0 m -64.23 156.03 30.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.219 -0.446 . . . . 51.25 110.902 -179.802 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 64.93 133.24 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.691 0.758 . . . . 73.4 110.881 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 134.67 28.52 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.712 2.275 . . . . 74.53 112.358 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -66.99 -29.69 69.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.26 -0.427 . . . . 63.52 110.865 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 75.21 -2.8 2.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.118 -0.492 . . . . 63.11 110.94 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 151' ' ' GLY . . . . . 0.636 ' O ' 'CA ' ' A' ' 302' ' ' ' CA' . . . 57.0 -117.3 9.31 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.718 -0.753 . . . . 71.41 112.475 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 138.9 38.82 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.649 2.233 . . . . 75.11 112.34 -179.912 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 103.16 -147.9 17.02 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.779 -0.724 . . . . 70.32 112.501 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -39.97 149.04 0.07 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.887 0.375 . . . . 73.25 110.9 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 155' ' ' THR . . . . . 0.636 HG23 ' HA2' ' A' ' 68' ' ' GLY . 0.9 OUTLIER 75.99 110.55 0.07 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.158 -0.474 . . . . 44.41 111.131 -179.957 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 156' ' ' LEU . . . . . 1.002 HD21 HG21 ' A' ' 186' ' ' ILE . 0.6 OUTLIER -96.1 -53.35 3.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.133 -0.485 . . . . 75.02 110.882 179.995 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 157' ' ' ALA . . . . . 0.573 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -161.63 147.71 13.91 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.209 -0.451 . . . . 71.42 111.069 179.8 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 24.5 p-80 -109.63 125.72 52.88 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 72.02 110.86 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -109.41 171.25 7.55 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.193 -0.458 . . . . 74.42 111.105 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -125.9 153.28 44.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 75.31 110.856 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 161' ' ' ALA . . . . . 0.757 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -86.27 165.46 33.54 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.605 0.717 . . . . 61.04 111.061 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 162' ' ' PRO . . . . . 0.757 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.7 Cg_endo -69.73 75.52 1.19 Allowed 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.696 2.264 . . . . 74.44 112.36 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -136.29 102.61 0.41 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.708 -0.758 . . . . 61.41 112.481 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 164' ' ' THR . . . . . 0.442 HG22 ' H ' ' A' ' 165' ' ' GLY . 0.2 OUTLIER 68.28 174.5 0.28 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.775 0.321 . . . . 73.1 111.135 -179.908 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 165' ' ' GLY . . . . . 0.442 ' H ' HG22 ' A' ' 164' ' ' THR . . . -52.07 -50.65 44.55 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.739 -0.743 . . . . 74.03 112.502 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 166' ' ' LEU . . . . . 0.675 HD13 ' O ' ' A' ' 166' ' ' LEU . 3.4 tm? -58.71 -31.19 68.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.845 0.355 . . . . 65.12 110.915 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -72.97 151.22 45.42 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.669 -0.777 . . . . 43.43 112.481 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 168' ' ' GLY . . . . . 0.65 ' O ' HG23 ' A' ' 134' ' ' ILE . . . 86.2 15.99 63.57 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.782 -0.723 . . . . 74.31 112.472 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -87.37 147.88 25.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.791 0.329 . . . . 63.41 110.898 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.58 130.38 56.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 74.21 111.088 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 171' ' ' HIS . . . . . 0.55 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 50.0 m170 -131.43 139.04 49.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.244 -0.435 . . . . 72.53 110.807 -179.948 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 48.5 m-85 -122.34 140.07 53.08 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.184 -0.462 . . . . 71.44 110.858 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 63.5 t0 -69.14 98.25 0.99 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.196 -0.456 . . . . 74.11 110.853 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.94 -16.46 12.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.157 -0.474 . . . . 72.25 110.857 -179.886 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -79.25 -16.25 56.76 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.112 -0.494 . . . . 73.32 110.85 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 27.8 mm-40 -81.99 -176.78 6.31 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.166 -0.47 . . . . 63.2 110.918 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 32.3 mtm180 -116.49 114.4 24.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 63.14 110.917 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 5.7 m95 -117.24 150.33 38.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.244 -0.434 . . . . 72.31 110.855 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 179' ' ' THR . . . . . 0.581 HG21 ' HB3' ' A' ' 182' ' ' SER . 12.2 t -179.82 163.87 1.16 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.231 -0.441 . . . . 74.13 111.14 -179.934 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -122.27 -67.53 0.95 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.253 -0.43 . . . . 45.33 110.839 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -67.49 -10.73 58.29 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.748 -0.739 . . . . 62.41 112.495 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 182' ' ' SER . . . . . 0.581 ' HB3' HG21 ' A' ' 179' ' ' THR . 0.2 OUTLIER -98.28 -24.51 15.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.856 0.36 . . . . 64.5 110.888 -179.768 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 183' ' ' SER . . . . . 0.458 ' C ' ' O ' ' A' ' 182' ' ' SER . 53.0 p 32.69 61.58 0.36 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.085 -0.507 . . . . 64.12 110.877 -179.83 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 6.0 tt -116.89 -33.7 4.68 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 74.2 110.894 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -121.33 -136.45 5.04 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.734 -0.746 . . . . 73.01 112.503 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 186' ' ' ILE . . . . . 1.002 HG21 HD21 ' A' ' 156' ' ' LEU . 7.7 mm -79.36 97.41 2.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.871 0.367 . . . . 73.22 111.165 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -50.94 121.32 5.84 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.154 -0.476 . . . . 71.31 110.879 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 188' ' ' PHE . . . . . 0.753 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.5 t80 -54.2 -35.68 62.64 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.224 -0.444 . . . . 75.45 110.913 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 189' ' ' LEU . . . . . 0.52 HD12 ' HE2' ' A' ' 224' ' ' PHE . 0.2 OUTLIER -67.37 -48.17 68.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.094 -0.503 . . . . 52.02 110.865 -179.998 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 9.7 t80 -69.88 -37.45 76.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.152 -0.476 . . . . 74.22 110.935 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 191' ' ' ALA . . . . . 0.662 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -72.55 -35.9 68.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.099 -0.501 . . . . 50.03 111.092 179.895 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 192' ' ' ALA . . . . . 0.66 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -57.13 -45.19 83.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.251 -0.431 . . . . 52.11 111.105 179.952 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.78 -41.03 85.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.189 -0.46 . . . . 72.43 111.162 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 13.9 t-160 -73.1 -44.97 59.66 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.215 -0.448 . . . . 71.44 110.872 179.89 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -69.48 -48.15 61.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.244 -0.435 . . . . 71.01 111.101 179.894 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 196' ' ' LEU . . . . . 1.016 HD12 HD13 ' A' ' 113' ' ' LEU . 4.4 mm? -64.06 -39.42 94.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.114 -0.493 . . . . 74.51 110.909 -179.908 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -63.31 -25.15 68.13 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.745 -0.741 . . . . 52.23 112.526 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 198' ' ' HIS . . . . . . . . . . . . . 5.5 m-70 -68.7 -43.6 75.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.834 0.35 . . . . 75.21 110.857 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 199' ' ' SER . . . . . 0.46 ' O ' ' HD3' ' A' ' 162' ' ' PRO . 0.2 OUTLIER -58.83 -25.68 63.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.233 -0.439 . . . . 71.13 110.921 -179.788 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -85.05 1.13 49.11 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.104 -0.498 . . . . 64.13 110.891 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 85.19 -9.36 67.02 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.787 -0.72 . . . . 50.41 112.525 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 202' ' ' MET . . . . . 0.448 ' CE ' ' HB ' ' A' ' 234' ' ' ILE . 0.0 OUTLIER -54.2 134.52 44.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.808 0.337 . . . . 63.21 110.828 -179.964 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -101.05 172.69 23.66 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.719 -0.753 . . . . 64.44 112.465 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 204' ' ' HIS . . . . . 0.42 ' HA ' ' HB3' ' A' ' 212' ' ' MET . 20.7 m-70 -67.45 163.64 20.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.827 0.346 . . . . 74.32 110.864 -179.96 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -124.66 153.47 42.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.223 -0.444 . . . . 53.34 110.856 -179.781 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 3.1 p -87.64 -4.27 58.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.156 -0.475 . . . . 72.22 110.819 -179.775 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.19 135.88 84.62 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.58 0.705 . . . . 65.11 110.924 179.952 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -69.83 -6.15 17.95 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.594 2.196 . . . . 74.53 112.292 -179.855 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -130.05 29.96 4.87 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.227 -0.442 . . . . 63.52 110.9 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 210' ' ' ALA . . . . . 0.478 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.27 145.33 26.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.142 -0.481 . . . . 62.23 111.09 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 211' ' ' VAL . . . . . 0.448 HG12 ' OD2' ' A' ' 230' ' ' ASP . 0.4 OUTLIER -67.21 -27.67 39.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.153 -0.476 . . . . 62.04 111.199 179.933 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 212' ' ' MET . . . . . 0.42 ' HB3' ' HA ' ' A' ' 204' ' ' HIS . 1.3 ttm -97.11 8.61 44.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.13 -0.486 . . . . 75.22 110.861 179.918 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 213' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -55.78 116.55 12.44 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.697 0.761 . . . . 73.43 110.845 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.89 -18.41 36.43 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.711 2.274 . . . . 63.01 112.282 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.7 51.1 2.05 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.239 -0.437 . . . . 74.24 111.139 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 8.4 t80 -77.14 128.8 35.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.265 -0.425 . . . . 74.14 110.974 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -164.34 -130.22 1.11 Allowed Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.669 -0.777 . . . . 74.22 112.421 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -51.78 149.99 4.35 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.879 0.371 . . . . 64.22 110.895 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . 87.69 99.59 0.89 Allowed Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.754 -0.736 . . . . 72.24 112.494 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 220' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -112.69 101.49 52.92 Favored Pre-proline 0 C--N 1.328 -0.356 0 CA-C-O 121.711 0.767 . . . . 41.43 110.865 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.72 124.83 11.48 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.652 2.234 . . . . 73.42 112.341 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -80.57 -20.54 43.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.258 -0.428 . . . . 74.21 110.87 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -129.32 37.24 4.05 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.183 -0.462 . . . . 60.33 110.87 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 224' ' ' PHE . . . . . 0.52 ' HE2' HD12 ' A' ' 189' ' ' LEU . 0.3 OUTLIER -52.33 157.39 1.45 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.162 -0.472 . . . . 65.01 110.862 179.972 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 3.0 mttp -144.51 168.99 18.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.093 -0.503 . . . . 64.24 110.866 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 226' ' ' LEU . . . . . 0.819 HD13 ' HG2' ' A' ' 119' ' ' GLU . 21.9 mt -60.08 148.82 34.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 53.44 110.845 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 227' ' ' SER . . . . . 0.505 ' O ' HG12 ' A' ' 231' ' ' ILE . 0.0 OUTLIER -86.93 150.78 23.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.147 -0.479 . . . . 74.21 110.853 -179.95 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -64.38 -64.21 0.94 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.113 -0.494 . . . . 74.54 110.859 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 229' ' ' ASP . . . . . 0.404 ' HA ' ' HG2' ' A' ' 232' ' ' LYS . 17.9 t70 -55.48 -26.92 45.21 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.174 -0.466 . . . . 72.22 110.864 -179.982 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 230' ' ' ASP . . . . . 0.448 ' OD2' HG12 ' A' ' 211' ' ' VAL . 61.7 t0 -69.73 -50.23 45.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.155 -0.475 . . . . 74.23 110.896 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 231' ' ' ILE . . . . . 0.675 HD11 HD22 ' A' ' 226' ' ' LEU . 3.9 mm -69.75 -40.59 79.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.183 -0.462 . . . . 73.41 111.154 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 232' ' ' LYS . . . . . 0.411 ' HG3' ' N ' ' A' ' 233' ' ' GLY . 0.0 OUTLIER -56.46 -31.93 64.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.222 -0.445 . . . . 65.42 110.918 179.835 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 233' ' ' GLY . . . . . 0.411 ' N ' ' HG3' ' A' ' 232' ' ' LYS . . . -64.82 -49.72 62.04 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.729 -0.748 . . . . 63.43 112.529 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 234' ' ' ILE . . . . . 0.448 ' HB ' ' CE ' ' A' ' 202' ' ' MET . 8.4 tt -72.99 -30.28 31.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 120.76 0.314 . . . . 71.54 111.104 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -61.46 -29.29 69.87 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.233 -0.439 . . . . 70.33 110.896 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 236' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.58 -25.46 59.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.267 -0.424 . . . . 51.21 110.887 -179.998 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 237' ' ' LEU . . . . . 0.708 HD22 ' HD3' ' A' ' 83' ' ' LYS . 9.7 tt -97.42 -26.22 14.93 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.259 -0.428 . . . . 75.41 110.899 179.89 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 238' ' ' TYR . . . . . 0.44 ' CD1' HG13 ' A' ' 234' ' ' ILE . 5.4 m-85 -92.44 -35.38 13.69 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.235 -0.439 . . . . 51.24 110.881 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -149.34 -118.23 0.92 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.735 -0.745 . . . . 32.22 112.482 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 15.8 ttmm -86.73 148.28 25.49 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.827 0.346 . . . . 75.42 110.878 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -80.29 -169.11 1.93 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.197 -0.456 . . . . 73.34 110.893 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 5.5 m -143.02 -69.9 0.33 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.247 -0.433 . . . . 62.42 110.874 -179.787 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -133.97 -41.44 0.83 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.11 -0.495 . . . . 72.13 110.954 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 63.22 99.14 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.146 -0.479 . . . . 62.23 110.837 -179.9 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 1.1 ttm180 -136.68 -66.01 0.54 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.172 -0.467 . . . . 70.43 110.912 -179.913 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 52.04 78.51 0.12 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.165 -0.471 . . . . 72.11 110.911 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 16.0 ptmt . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.194 -0.457 . . . . 74.13 110.874 179.877 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 302' ' ' ' CA' . . . . . 0.636 'CA ' ' O ' ' A' ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' -2' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.233 0.191 0 CA-C-O 121.624 0.726 . . . . 73.02 110.895 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' -1' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.76 172.08 13.29 Favored 'Trans proline' 0 C--O 1.232 0.221 0 C-N-CA 122.701 2.267 . . . . 71.15 112.332 179.877 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 0' ' ' LEU . . . . . 0.461 HD23 ' HG3' ' A' ' 3' ' ' GLU . 11.8 tp -174.76 72.52 0.3 Allowed Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.525 0.678 . . . . 62.13 110.888 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.72 -179.63 3.03 Favored 'Trans proline' 0 C--O 1.231 0.154 0 C-N-CA 122.682 2.255 . . . . 64.14 112.356 179.83 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 39.58 40.86 0.67 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.211 -0.45 . . . . 60.51 110.873 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.461 ' HG3' HD23 ' A' ' 0' ' ' LEU . 0.1 OUTLIER -95.44 -52.86 3.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.209 -0.451 . . . . 74.01 110.87 -179.99 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.404 ' O ' ' HE2' ' A' ' 7' ' ' MET . . . -68.46 -33.97 75.12 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.214 -0.448 . . . . 71.4 111.076 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -55.9 -25.14 44.35 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.745 -0.741 . . . . 60.51 112.505 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -108.94 21.3 27.65 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.728 -0.749 . . . . 54.22 112.451 -179.881 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' MET . . . . . 0.404 ' HE2' ' O ' ' A' ' 4' ' ' ALA . 1.0 OUTLIER -84.74 164.2 18.69 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.812 0.339 . . . . 72.23 110.832 -179.938 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -112.45 168.24 9.8 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.206 -0.452 . . . . 73.24 110.911 -179.842 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -54.56 -31.92 57.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.183 -0.462 . . . . 50.12 110.95 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.72 -42.87 85.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.185 -0.461 . . . . 72.33 110.901 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -61.81 -42.53 99.13 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.125 -0.489 . . . . 72.14 110.913 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 6.5 t-105 -73.19 -33.26 65.31 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.207 -0.452 . . . . 71.22 110.847 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -63.96 -36.67 84.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.341 -0.39 . . . . 72.51 110.902 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -63.07 -36.89 85.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 61.24 110.897 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.646 ' HB1' ' HE3' ' A' ' 62' ' ' MET . . . -57.16 -37.36 71.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.166 -0.47 . . . . 54.34 111.099 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.551 ' OE1' HD12 ' A' ' 35' ' ' LEU . 1.9 tt0 -67.16 -43.0 83.38 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.2 -0.455 . . . . 73.12 110.917 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -70.08 -31.41 68.99 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.162 -0.472 . . . . 72.4 110.882 180.0 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 14.8 m-85 -67.68 -50.5 57.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.188 -0.46 . . . . 75.11 110.948 -179.892 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.488 HD13 ' C ' ' A' ' 19' ' ' LEU . 2.8 tm? -67.82 -33.46 74.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.094 -0.503 . . . . 72.51 110.836 -179.94 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 4.9 tptt -57.15 -39.82 76.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.196 -0.456 . . . . 74.41 110.902 179.849 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.463 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 8.8 ptm180 -83.91 -25.29 30.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.242 -0.435 . . . . 74.05 110.917 179.912 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.427 ' HB2' ' HA ' ' A' ' 19' ' ' LEU . 0.4 OUTLIER -59.08 -20.17 50.93 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 74.31 110.865 -179.936 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.659 ' CE2' ' HB2' ' A' ' 24' ' ' LEU . 3.8 p90 -120.57 -49.54 2.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.182 -0.463 . . . . 72.55 110.958 -179.868 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.659 ' HB2' ' CE2' ' A' ' 23' ' ' TYR . 49.5 mt -166.38 -119.76 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.127 -0.488 . . . . 75.43 110.912 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.483 ' HB2' ' O ' ' A' ' 24' ' ' LEU . 0.3 OUTLIER 175.24 89.36 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.195 -0.457 . . . . 71.41 110.914 -179.957 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 62.1 m-20 -125.3 90.28 3.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.126 -0.488 . . . . 74.25 110.868 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.3 p -50.07 -28.21 6.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.243 -0.435 . . . . 62.15 110.876 -179.794 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -56.01 -33.17 64.64 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.057 -0.519 . . . . 74.51 110.877 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 87.5 m -79.98 -20.39 45.63 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.172 -0.467 . . . . 70.44 111.084 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.7 tttt -50.99 103.61 0.06 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.209 -0.45 . . . . 73.33 110.867 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -175.42 164.84 3.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.222 -0.444 . . . . 64.43 110.878 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.56 -37.34 63.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.147 -0.478 . . . . 70.21 111.121 179.826 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -69.58 -47.56 63.16 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.179 -0.464 . . . . 35.31 110.865 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.12 -22.98 62.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.185 -0.462 . . . . 74.02 110.829 -179.876 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.551 HD12 ' OE1' ' A' ' 16' ' ' GLN . 1.3 tt -58.76 -44.35 90.57 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.197 -0.456 . . . . 72.52 110.861 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.445 ' N ' HD23 ' A' ' 35' ' ' LEU . 1.1 tp10 -57.24 -52.64 64.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.268 -0.424 . . . . 73.13 110.931 179.911 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.48 -36.76 84.83 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.153 -0.476 . . . . 63.32 111.1 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.459 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 2.7 mmtm -65.19 -49.13 70.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.189 -0.46 . . . . 72.32 110.861 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 35' ' ' LEU . 4.6 mt -62.64 -35.54 79.93 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.209 -0.45 . . . . 72.11 110.874 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 26.0 tttt -60.1 -45.6 92.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.191 -0.459 . . . . 62.43 110.888 179.841 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.459 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 1.7 pt-20 -60.56 -32.73 71.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.192 -0.458 . . . . 75.11 110.877 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.537 ' HE2' HD11 ' A' ' 61' ' ' ILE . 13.9 ttt -65.68 -34.05 77.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.145 -0.48 . . . . 63.43 110.887 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.752 ' OE1' HD11 ' A' ' 48' ' ' LEU . 2.7 mm-40 -64.11 -39.65 94.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.239 -0.437 . . . . 74.45 110.847 -179.929 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.2 mmpt? -68.52 -29.21 67.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.192 -0.458 . . . . 71.43 110.915 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -70.05 -42.31 73.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 73.32 110.923 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.584 ' HB3' HD23 ' A' ' 48' ' ' LEU . 10.4 m-85 -82.1 -35.33 28.7 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.206 -0.452 . . . . 70.43 110.803 -179.871 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.402 ' HA3' ' HB2' ' A' ' 206' ' ' SER . . . 104.74 -10.15 48.68 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.718 -0.753 . . . . 64.34 112.414 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.752 HD11 ' OE1' ' A' ' 43' ' ' GLN . 0.7 OUTLIER -60.66 138.57 93.05 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.607 0.718 . . . . 64.11 110.941 -179.927 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.702 ' O ' HG23 ' A' ' 51' ' ' THR . 53.9 Cg_endo -69.73 -53.25 0.28 Allowed 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.643 2.229 . . . . 74.5 112.386 179.844 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.438 ' O ' HD12 ' A' ' 48' ' ' LEU . 0.9 OUTLIER -52.39 108.23 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.242 -0.435 . . . . 71.22 111.137 179.847 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.702 HG23 ' O ' ' A' ' 49' ' ' PRO . 68.2 p -116.22 168.53 10.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.214 -0.448 . . . . 73.25 111.174 179.917 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 65.19 12.51 55.52 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.763 -0.732 . . . . 64.24 112.495 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.2 ppp? -124.72 161.12 27.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.836 0.35 . . . . 75.23 110.868 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.546 HD21 ' CB ' ' A' ' 15' ' ' ALA . 18.4 tp -162.53 94.03 0.86 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.213 -0.449 . . . . 73.4 110.933 179.999 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.413 ' HA ' HG13 ' A' ' 59' ' ' ILE . 0.6 OUTLIER 172.9 -26.13 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.122 -0.49 . . . . 44.35 110.927 179.963 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 44.3 m -89.34 -100.5 0.09 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.171 -0.468 . . . . 75.25 110.851 -179.819 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 12.9 tpt180 -84.62 -28.23 26.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.126 -0.488 . . . . 61.22 110.874 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.495 HG21 HE22 ' A' ' 43' ' ' GLN . 97.3 t -62.68 -41.33 91.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.218 -0.446 . . . . 70.12 111.112 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.427 HD11 ' HB2' ' A' ' 15' ' ' ALA . 1.8 mm -74.97 -31.58 25.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.177 -0.465 . . . . 74.43 111.167 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -60.06 -44.12 94.95 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 73.45 110.86 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.653 HG21 HG23 ' A' ' 215' ' ' THR . 24.4 pt -70.34 -30.01 41.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.175 -0.466 . . . . 74.52 111.147 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.646 ' HE3' ' HB1' ' A' ' 15' ' ' ALA . 2.1 mmm -67.77 -35.26 78.38 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.144 -0.48 . . . . 74.01 110.832 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -87.67 -24.06 24.02 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.209 -0.451 . . . . 42.22 110.861 -179.874 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 50.5 mtmt -85.02 113.88 52.61 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.596 0.712 . . . . 65.34 110.864 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.78 148.05 64.07 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.71 2.273 . . . . 72.11 112.361 179.881 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.563 ' O ' HD23 ' A' ' 156' ' ' LEU . 1.5 ppt_? -154.7 -59.48 0.11 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.252 -0.431 . . . . 71.51 110.829 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -146.14 144.88 30.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.215 -0.448 . . . . 55.3 110.884 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.554 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -101.75 15.37 57.09 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.781 -0.723 . . . . 64.23 112.491 -179.922 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.598 HG12 ' HD2' ' A' ' 70' ' ' PRO . 0.1 OUTLIER -101.86 137.0 19.41 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.642 0.734 . . . . 74.23 111.111 -179.982 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.598 ' HD2' HG12 ' A' ' 69' ' ' VAL . 54.2 Cg_endo -69.82 165.41 31.12 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.632 2.221 . . . . 63.44 112.387 179.904 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -135.01 46.27 2.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.253 -0.43 . . . . 74.45 110.867 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -140.06 129.78 28.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.263 -0.426 . . . . 53.43 111.066 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -130.9 170.44 14.42 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.103 -0.498 . . . . 73.13 111.073 179.846 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -164.14 172.77 13.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.256 -0.429 . . . . 73.31 110.881 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 51.7 t80 -51.6 104.2 0.08 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.129 -0.487 . . . . 70.41 110.907 -179.872 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.5 p -140.98 178.43 7.37 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.1 -0.5 . . . . 74.2 110.852 -179.859 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 7.9 mt -95.96 53.95 1.44 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.121 -0.491 . . . . 70.34 110.906 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -78.04 160.18 74.26 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.655 0.741 . . . . 71.24 110.831 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 133.95 26.78 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.677 2.251 . . . . 73.34 112.336 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -51.26 137.07 23.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.191 -0.458 . . . . 74.43 110.91 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 63.65 94.8 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.689 0.757 . . . . 70.4 110.894 -179.836 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.7 -50.51 0.46 Allowed 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.661 2.24 . . . . 71.11 112.308 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.821 ' HD2' HD22 ' A' ' 237' ' ' LEU . 5.4 mttp -63.34 151.02 41.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.269 -0.423 . . . . 64.45 110.898 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' TRP . . . . . 0.686 ' CE3' HG21 ' A' ' 89' ' ' VAL . 39.7 m0 -50.97 109.49 0.33 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.198 -0.455 . . . . 73.31 110.961 179.902 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -105.02 -14.7 15.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.25 -0.432 . . . . 65.3 111.183 -179.957 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -58.16 153.5 14.82 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.188 -0.46 . . . . 70.34 110.897 -179.879 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 14.6 mmtp -65.91 -30.62 71.24 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.178 -0.465 . . . . 71.12 110.91 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -154.79 142.25 12.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.208 -0.451 . . . . 74.14 111.132 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.686 HG21 ' CE3' ' A' ' 84' ' ' TRP . 54.8 t -123.61 139.21 50.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.183 -0.462 . . . . 72.25 111.082 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.488 ' C ' ' HB1' ' A' ' 132' ' ' ALA . 31.6 p -115.96 147.12 41.5 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.113 -0.494 . . . . 71.01 111.099 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 17.5 p90 -131.36 146.6 52.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.21 -0.45 . . . . 70.51 110.971 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 9.1 ttt180 -147.71 138.47 23.31 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.082 -0.508 . . . . 71.25 110.897 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.517 HD11 ' HA ' ' A' ' 106' ' ' ASP . 9.8 mm -75.21 135.09 27.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.223 -0.444 . . . . 72.4 111.156 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.456 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 21.1 t -91.47 -40.27 12.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.187 -0.461 . . . . 60.2 111.142 179.829 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 35.1 t -151.05 169.36 22.02 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.196 -0.456 . . . . 64.24 110.807 -179.835 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 13.2 p90 -131.86 155.09 48.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.078 -0.51 . . . . 72.25 110.95 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.7 t -103.32 141.71 35.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.129 -0.487 . . . . 64.11 111.14 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 2.1 mmt180 -52.53 -18.45 1.72 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.214 -0.448 . . . . 72.14 110.842 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.03 -37.42 87.54 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.199 -0.455 . . . . 74.13 110.86 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.617 HD11 ' HA ' ' A' ' 179' ' ' THR . 0.9 OUTLIER -142.09 152.4 61.45 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.594 0.711 . . . . 72.52 110.895 -179.957 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 101' ' ' PRO . . . . . 0.567 ' HB2' HG22 ' A' ' 103' ' ' ILE . 54.4 Cg_endo -69.71 151.21 69.3 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.724 2.283 . . . . 73.11 112.311 179.832 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -52.96 -26.29 14.68 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.196 -0.457 . . . . 74.11 110.814 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.567 HG22 ' HB2' ' A' ' 101' ' ' PRO . 5.5 tt -77.1 -39.51 29.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.312 -0.403 . . . . 74.02 111.124 179.9 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 104' ' ' THR . . . . . 0.785 ' O ' HD22 ' A' ' 108' ' ' LEU . 3.4 m -69.12 -36.79 77.87 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.241 -0.436 . . . . 52.11 111.177 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.8 HG13 ' CZ ' ' A' ' 188' ' ' PHE . 57.5 t -71.27 -42.15 74.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.172 -0.467 . . . . 71.51 111.165 179.853 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.645 ' O ' HG22 ' A' ' 109' ' ' VAL . 22.9 t0 -68.66 -38.21 80.25 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.217 -0.447 . . . . 63.44 110.928 179.888 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 107' ' ' ARG . . . . . 0.483 ' HG3' ' N ' ' A' ' 108' ' ' LEU . 0.0 OUTLIER -70.0 -33.49 72.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.153 -0.476 . . . . 75.02 110.869 -179.869 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.785 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -64.64 -47.76 77.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.188 -0.46 . . . . 71.04 110.993 179.929 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.748 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.3 m -55.16 -41.32 59.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 72.31 111.201 179.797 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.464 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 44.8 t -70.0 -34.67 73.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.174 -0.466 . . . . 72.14 110.892 -179.906 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.451 ' CG ' HD21 ' A' ' 189' ' ' LEU . 0.3 OUTLIER -63.46 -34.64 78.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.11 -0.496 . . . . 74.35 110.887 179.948 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -92.27 -40.42 10.96 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.233 -0.44 . . . . 74.32 111.069 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 1.055 HD13 HD12 ' A' ' 196' ' ' LEU . 9.2 tp -64.4 -32.59 74.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.224 -0.444 . . . . 72.0 110.977 179.974 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 39.7 t30 -66.66 -38.77 87.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.209 -0.45 . . . . 72.34 110.886 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' MET . . . . . 0.734 ' O ' HD11 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -60.84 -34.7 74.97 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.167 -0.469 . . . . 54.12 110.906 179.906 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 116' ' ' TRP . . . . . 0.407 ' O ' HG12 ' A' ' 120' ' ' ILE . 8.7 m95 -68.52 -38.81 81.22 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.186 -0.461 . . . . 75.23 110.872 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 117' ' ' GLY . . . . . 0.451 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -73.64 -33.91 57.48 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.76 -0.733 . . . . 73.32 112.456 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.7 -15.04 57.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.722 0.296 . . . . 72.42 110.863 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.807 ' HB2' HG23 ' A' ' 231' ' ' ILE . 5.1 pt-20 -106.25 13.56 28.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.264 -0.426 . . . . 75.24 110.954 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.998 HD12 HD12 ' A' ' 122' ' ' LEU . 7.3 pt -149.79 142.48 15.83 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.635 0.731 . . . . 71.34 111.157 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -69.86 25.32 0.18 Allowed 'Trans proline' 0 C--O 1.232 0.201 0 C-N-CA 122.641 2.228 . . . . 72.21 112.321 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.998 HD12 HD12 ' A' ' 120' ' ' ILE . 14.3 mt -81.49 -159.42 0.27 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.206 -0.452 . . . . 73.22 110.934 179.97 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.456 ' H ' ' HB3' ' A' ' 122' ' ' LEU . 27.6 t-80 -157.25 137.26 12.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.237 -0.438 . . . . 74.12 110.929 179.857 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 124' ' ' PHE . . . . . 0.411 ' CE2' ' HA3' ' A' ' 117' ' ' GLY . 20.9 m-85 -117.68 138.23 52.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.197 -0.456 . . . . 75.54 110.931 -179.897 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -118.27 141.48 48.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.149 -0.478 . . . . 75.14 110.821 -179.815 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.55 154.63 27.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.171 -0.468 . . . . 72.22 110.915 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 127' ' ' VAL . . . . . 0.718 HG11 ' HB2' ' A' ' 132' ' ' ALA . 19.5 m -103.38 126.91 57.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.189 -0.46 . . . . 50.13 111.132 179.894 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.427 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -145.13 -25.99 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.208 -0.451 . . . . 74.43 111.152 179.901 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 129' ' ' TRP . . . . . 0.427 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -139.76 109.27 6.22 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.176 -0.465 . . . . 71.25 110.877 179.954 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 103.0 -167.48 17.17 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.682 -0.77 . . . . 62.11 112.469 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -101.76 156.15 17.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.741 0.305 . . . . 63.25 111.158 -179.842 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 132' ' ' ALA . . . . . 0.718 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -111.72 165.29 12.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.246 -0.433 . . . . 51.34 111.135 179.858 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -74.45 -44.57 51.12 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.242 -0.436 . . . . 75.41 110.893 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 134' ' ' ILE . . . . . 0.606 HG23 ' O ' ' A' ' 168' ' ' GLY . 3.8 mm -89.39 113.3 25.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 70.51 111.172 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 135' ' ' MET . . . . . 0.456 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 8.4 mmm -101.82 122.59 44.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.177 -0.465 . . . . 72.43 110.877 179.864 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -107.0 93.42 2.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 70.04 111.123 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -130.17 173.1 20.03 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.709 -0.757 . . . . 63.34 112.418 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 138' ' ' PHE . . . . . 0.553 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 51.4 m-85 -108.48 149.83 28.26 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.854 0.359 . . . . 74.01 110.904 -179.877 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.553 ' HB2' ' O ' ' A' ' 138' ' ' PHE . . . 170.35 166.12 0.07 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.165 -0.47 . . . . 71.21 111.118 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.45 ' HB2' ' CB ' ' A' ' 149' ' ' PHE . 1.9 ptt180 -109.59 174.14 6.0 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.234 -0.439 . . . . 62.21 110.908 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 141' ' ' GLY . . . . . 0.452 ' H ' ' HA ' ' A' ' 149' ' ' PHE . . . -55.34 -18.93 15.53 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.676 -0.773 . . . . 74.24 112.53 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 142' ' ' ALA . . . . . 0.461 ' HB2' ' HD2' ' A' ' 149' ' ' PHE . . . -91.43 13.18 18.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.793 0.33 . . . . 75.03 111.082 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 143' ' ' HIS . . . . . 0.517 ' HB3' ' HB1' ' A' ' 139' ' ' ALA . 2.2 p80 -77.91 -15.75 58.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.212 -0.449 . . . . 71.11 110.855 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 128.27 49.62 0.15 Allowed Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.74 -0.743 . . . . 45.51 112.492 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -153.26 169.55 22.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.827 0.346 . . . . 72.14 110.863 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.38 165.47 11.81 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.216 -0.447 . . . . 51.25 110.902 -179.799 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 12.6 m-85 64.75 134.07 0.04 OUTLIER Pre-proline 0 C--N 1.327 -0.377 0 CA-C-O 121.724 0.773 . . . . 73.4 110.919 -179.843 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 151.35 68.85 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.674 2.249 . . . . 74.53 112.337 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 149' ' ' PHE . . . . . 0.461 ' HD2' ' HB2' ' A' ' 142' ' ' ALA . 10.4 p90 -53.19 -44.63 68.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.265 -0.425 . . . . 63.52 110.861 -179.979 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 75.52 -21.23 0.31 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.088 -0.506 . . . . 63.11 110.882 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 151' ' ' GLY . . . . . 0.45 ' H ' ' C ' ' A' ' 149' ' ' PHE . . . 68.04 -139.83 35.06 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.726 -0.749 . . . . 71.41 112.434 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.69 142.43 48.2 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.647 2.231 . . . . 75.11 112.357 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 153' ' ' GLY . . . . . 0.449 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 104.38 -143.47 15.69 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.768 -0.73 . . . . 70.32 112.437 179.918 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 154' ' ' ASN . . . . . 0.449 ' C ' ' O ' ' A' ' 153' ' ' GLY . 4.1 p30 -34.52 141.23 0.06 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.922 0.392 . . . . 73.25 110.867 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 75.72 117.88 0.06 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.126 -0.488 . . . . 44.41 111.098 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 156' ' ' LEU . . . . . 1.047 HD21 HG21 ' A' ' 186' ' ' ILE . 1.2 tp -107.07 -51.8 2.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.464 . . . . 75.02 110.955 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 157' ' ' ALA . . . . . 0.554 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -154.67 149.58 26.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.209 -0.45 . . . . 71.42 111.025 179.787 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 29.3 p-80 -116.39 110.94 19.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.172 -0.467 . . . . 72.02 110.816 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -110.95 170.3 8.19 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.313 -0.403 . . . . 74.42 111.118 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -146.65 164.35 32.94 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.208 -0.451 . . . . 75.31 110.868 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 161' ' ' ALA . . . . . 0.729 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -93.74 164.99 18.96 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.498 0.666 . . . . 61.04 111.16 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 162' ' ' PRO . . . . . 0.729 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 54.1 Cg_endo -69.76 77.23 1.08 Allowed 'Trans proline' 0 C--O 1.231 0.169 0 C-N-CA 122.726 2.284 . . . . 74.44 112.35 -179.942 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -112.41 120.42 5.29 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.741 -0.742 . . . . 61.41 112.457 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 1.2 m 76.17 -58.97 0.52 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.789 0.328 . . . . 73.1 111.148 -179.827 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . 172.1 -56.49 0.17 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.784 -0.722 . . . . 74.03 112.483 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 166' ' ' LEU . . . . . 0.461 HD23 ' O ' ' A' ' 166' ' ' LEU . 1.3 tt -60.81 -18.08 53.37 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.83 0.348 . . . . 65.12 110.925 -179.926 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -71.03 176.91 36.25 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.757 -0.735 . . . . 43.43 112.494 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 168' ' ' GLY . . . . . 0.606 ' O ' HG23 ' A' ' 134' ' ' ILE . . . 76.47 13.63 83.22 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.711 -0.757 . . . . 74.31 112.536 -179.88 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -94.05 149.69 21.01 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.822 0.344 . . . . 63.41 110.887 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.33 130.9 55.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.249 -0.432 . . . . 74.21 111.148 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 171' ' ' HIS . . . . . 0.448 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 62.9 m170 -128.05 132.75 49.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.218 -0.446 . . . . 72.53 110.906 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 30.3 m-85 -112.04 139.2 47.75 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.216 -0.447 . . . . 71.44 110.919 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -70.22 99.74 1.57 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.206 -0.452 . . . . 74.11 110.869 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.78 -16.67 12.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.231 -0.441 . . . . 72.25 110.893 -179.896 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 -76.25 -16.07 59.88 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.182 -0.463 . . . . 73.32 110.859 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -87.95 -176.22 5.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 63.2 110.88 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 48.0 mtm180 -110.83 119.74 40.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.158 -0.474 . . . . 63.14 110.93 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 48.9 m95 -117.04 139.16 51.03 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.256 -0.429 . . . . 72.31 110.934 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 179' ' ' THR . . . . . 0.617 ' HA ' HD11 ' A' ' 100' ' ' LEU . 7.1 t -177.33 163.51 2.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.267 -0.424 . . . . 74.13 111.151 -179.924 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -125.65 -68.55 0.83 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.233 -0.44 . . . . 45.33 110.916 179.895 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -65.26 -11.16 51.34 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.745 -0.74 . . . . 62.41 112.416 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 182' ' ' SER . . . . . 0.46 ' HB2' HG21 ' A' ' 179' ' ' THR . 1.5 m -97.34 -24.42 15.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.833 0.349 . . . . 64.5 110.907 -179.831 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 183' ' ' SER . . . . . 0.438 ' C ' ' O ' ' A' ' 182' ' ' SER . 12.1 m 34.82 61.76 0.57 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.147 -0.479 . . . . 64.12 110.88 -179.824 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -116.9 -33.59 4.71 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.067 -0.515 . . . . 74.2 110.942 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -122.3 -136.38 4.9 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.671 -0.776 . . . . 73.01 112.442 179.893 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 186' ' ' ILE . . . . . 1.047 HG21 HD21 ' A' ' 156' ' ' LEU . 8.2 mm -79.41 99.53 3.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.814 0.34 . . . . 73.22 111.138 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -50.29 121.79 6.06 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.18 -0.464 . . . . 71.31 110.844 -179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 188' ' ' PHE . . . . . 0.8 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.7 t80 -53.85 -34.84 60.54 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.207 -0.451 . . . . 75.45 110.905 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 189' ' ' LEU . . . . . 0.451 HD21 ' CG ' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -67.25 -47.46 70.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 52.02 110.905 -179.966 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 13.1 m-30 -69.47 -41.44 76.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.226 -0.443 . . . . 74.22 110.893 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 191' ' ' ALA . . . . . 0.611 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -68.38 -35.91 78.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.177 -0.465 . . . . 50.03 111.094 179.846 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 192' ' ' ALA . . . . . 0.66 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -58.56 -44.61 89.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.199 -0.455 . . . . 52.11 111.125 179.919 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 193' ' ' THR . . . . . 0.5 HG21 HG21 ' A' ' 211' ' ' VAL . 0.9 OUTLIER -58.24 -42.9 87.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.152 -0.476 . . . . 72.43 111.178 -179.904 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 8.0 t-160 -72.84 -41.64 64.59 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.215 -0.448 . . . . 71.44 110.876 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -71.44 -47.92 52.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 71.01 111.095 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 196' ' ' LEU . . . . . 1.055 HD12 HD13 ' A' ' 113' ' ' LEU . 4.4 mm? -63.82 -44.34 93.54 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.312 -0.404 . . . . 74.51 110.955 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -58.85 -27.47 61.94 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.698 -0.763 . . . . 52.23 112.552 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 198' ' ' HIS . . . . . 0.407 ' CD2' HG21 ' A' ' 69' ' ' VAL . 4.9 m-70 -67.38 -43.79 80.52 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.778 0.323 . . . . 75.21 110.909 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.15 -26.33 64.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.232 -0.44 . . . . 71.13 110.855 -179.794 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -83.98 2.96 36.38 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.138 -0.483 . . . . 64.13 110.926 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 83.52 -8.04 66.55 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.759 -0.734 . . . . 50.41 112.469 179.904 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 202' ' ' MET . . . . . 0.555 ' SD ' HD12 ' A' ' 234' ' ' ILE . 0.0 OUTLIER -49.84 134.84 20.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.833 0.349 . . . . 63.21 110.85 -179.975 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -102.66 159.1 17.72 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.727 -0.749 . . . . 64.44 112.468 -179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 29.2 m-70 -58.7 158.26 8.21 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.786 0.327 . . . . 74.32 110.899 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -124.09 138.97 54.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.253 -0.43 . . . . 53.34 110.939 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 206' ' ' SER . . . . . 0.402 ' HB2' ' HA3' ' A' ' 47' ' ' GLY . 3.1 p -76.79 -4.46 43.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.131 -0.486 . . . . 72.22 110.829 -179.742 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.71 135.09 83.58 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.624 0.726 . . . . 65.11 110.899 179.904 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.72 -6.3 18.26 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.709 2.273 . . . . 74.53 112.328 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -123.1 22.89 9.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.222 -0.444 . . . . 63.52 110.942 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 210' ' ' ALA . . . . . 0.494 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.13 145.63 26.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.15 -0.477 . . . . 62.23 111.144 179.851 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 211' ' ' VAL . . . . . 0.5 HG21 HG21 ' A' ' 193' ' ' THR . 0.4 OUTLIER -69.56 -28.05 36.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.261 -0.427 . . . . 62.04 111.06 -179.987 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 8.5 mmm -95.4 12.91 27.59 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.197 -0.456 . . . . 75.22 110.871 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 213' ' ' TYR . . . . . 0.417 ' CE2' ' HB ' ' A' ' 215' ' ' THR . 1.9 t80 -54.88 112.29 3.9 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-O 121.672 0.748 . . . . 73.43 110.898 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 214' ' ' PRO . . . . . 0.415 ' HD2' ' HA ' ' A' ' 213' ' ' TYR . 53.9 Cg_endo -69.82 -17.62 37.18 Favored 'Trans proline' 0 C--O 1.233 0.234 0 C-N-CA 122.698 2.266 . . . . 63.01 112.285 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 215' ' ' THR . . . . . 0.653 HG23 HG21 ' A' ' 61' ' ' ILE . 0.2 OUTLIER -83.48 59.53 5.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.29 -0.414 . . . . 74.24 111.127 -179.956 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -49.93 122.7 6.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.223 -0.444 . . . . 74.14 110.861 -179.906 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . 137.23 95.1 0.38 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.718 -0.754 . . . . 74.22 112.431 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 1.4 t30 179.71 -168.48 0.1 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.843 0.354 . . . . 64.22 110.877 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . -50.31 107.39 0.34 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.719 -0.753 . . . . 72.24 112.515 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 220' ' ' ASP . . . . . 0.403 ' HA ' ' HD2' ' A' ' 221' ' ' PRO . 2.9 p-10 -75.22 113.88 29.87 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.54 0.686 . . . . 41.43 110.916 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 221' ' ' PRO . . . . . 0.403 ' HD2' ' HA ' ' A' ' 220' ' ' ASP . 53.8 Cg_endo -69.74 150.42 68.33 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.654 2.236 . . . . 73.42 112.364 -179.95 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.39 -31.21 33.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.217 -0.447 . . . . 74.21 110.977 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -124.5 -28.18 3.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.128 -0.487 . . . . 60.33 110.891 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER 67.04 141.3 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.16 -0.473 . . . . 65.01 110.823 179.97 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.92 163.43 32.82 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.08 -0.509 . . . . 64.24 110.851 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 226' ' ' LEU . . . . . 0.734 HD11 ' O ' ' A' ' 115' ' ' MET . 11.5 mt -60.75 148.98 37.06 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.199 -0.455 . . . . 53.44 110.951 179.863 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 227' ' ' SER . . . . . 0.494 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 1.2 t -87.51 151.89 22.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.231 -0.441 . . . . 74.21 110.804 -179.882 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 19.7 tt0 -62.34 -66.07 0.59 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.146 -0.479 . . . . 74.54 110.809 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -55.55 -26.19 41.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.191 -0.459 . . . . 72.22 110.885 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -69.15 -48.12 63.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.179 -0.464 . . . . 74.23 110.867 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 231' ' ' ILE . . . . . 0.807 HG23 ' HB2' ' A' ' 119' ' ' GLU . 7.9 mt -68.3 -43.21 84.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.197 -0.456 . . . . 73.41 111.059 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 2.0 pttp -62.84 -31.85 72.95 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.232 -0.44 . . . . 65.42 110.915 179.84 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -62.62 -49.95 68.68 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.813 -0.708 . . . . 63.43 112.473 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 234' ' ' ILE . . . . . 0.555 HD12 ' SD ' ' A' ' 202' ' ' MET . 6.7 tt -73.07 -30.83 32.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.865 0.364 . . . . 71.54 111.174 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -68.67 -24.03 64.47 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.123 -0.489 . . . . 70.33 110.977 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 236' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.76 -28.17 60.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.126 -0.488 . . . . 51.21 110.915 179.911 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 237' ' ' LEU . . . . . 0.821 HD22 ' HD2' ' A' ' 83' ' ' LYS . 10.3 tt -98.02 -29.36 13.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.149 -0.478 . . . . 75.41 110.889 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 238' ' ' TYR . . . . . 0.492 ' CE2' HD11 ' A' ' 122' ' ' LEU . 27.9 m-85 -91.99 -35.46 13.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.245 -0.434 . . . . 51.24 110.916 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -134.24 -119.92 2.02 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.784 -0.722 . . . . 32.22 112.479 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 3.6 ttpp -125.06 121.04 33.19 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.812 0.339 . . . . 75.42 110.952 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 1.5 tpt180 179.91 178.37 0.59 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 73.34 110.886 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 1.4 p 52.9 -171.07 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.175 -0.466 . . . . 62.42 110.868 -179.803 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 9.2 p-10 -165.87 -40.89 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.148 -0.478 . . . . 72.13 110.902 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 14.8 p -139.54 -173.52 3.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.208 -0.451 . . . . 62.23 110.859 -179.829 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 1.3 ptm180 -69.26 153.23 43.98 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.185 -0.462 . . . . 70.43 110.891 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -173.23 -45.57 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 72.11 110.875 179.942 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 116.284 -0.417 . . . . 74.13 110.901 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 302' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' -2' ' ' LEU . . . . . . . . . . . . . 16.8 tp . . . . . 0 C--O 1.232 0.153 0 CA-C-O 121.68 0.752 . . . . 73.02 110.953 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' -1' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.71 177.66 5.32 Favored 'Trans proline' 0 C--O 1.233 0.235 0 C-N-CA 122.718 2.279 . . . . 71.15 112.352 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 2.2 mt -133.94 73.36 71.07 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-O 121.687 0.756 . . . . 62.13 110.951 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.68 -173.67 0.75 Allowed 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.731 2.287 . . . . 64.14 112.373 179.867 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 -86.09 99.78 11.72 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.246 -0.434 . . . . 60.51 110.902 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -95.27 -25.52 16.31 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.225 -0.443 . . . . 74.01 110.876 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.438 ' HB2' ' HB2' ' A' ' 55' ' ' ASN . . . -56.53 -34.08 66.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.184 -0.462 . . . . 71.4 111.085 179.872 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -55.91 -24.81 43.29 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.755 -0.736 . . . . 60.51 112.541 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -108.79 20.57 29.13 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.759 -0.734 . . . . 54.22 112.481 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 3.0 mtp -97.76 162.82 13.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.8 0.334 . . . . 72.23 110.844 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -112.77 168.49 9.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.282 -0.417 . . . . 73.24 110.887 -179.804 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -55.63 -32.08 62.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.201 -0.454 . . . . 50.12 110.852 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -63.48 -42.77 98.55 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.211 -0.45 . . . . 72.33 110.944 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.8 -42.91 99.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.162 -0.472 . . . . 72.14 110.896 179.894 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 19.4 t-105 -73.04 -32.98 65.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.166 -0.47 . . . . 71.22 110.886 -179.875 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -72.26 -42.2 65.89 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.19 -0.459 . . . . 72.51 110.892 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -63.54 -36.85 85.15 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.156 -0.475 . . . . 61.24 110.944 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.19 -34.85 68.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.113 -0.494 . . . . 54.34 111.104 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -69.88 -37.83 76.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.242 -0.435 . . . . 73.12 110.987 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.406 ' HA ' ' HD2' ' A' ' 20' ' ' LYS . 1.9 m-20 -77.47 -31.56 53.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.179 -0.464 . . . . 72.4 110.811 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 4.0 m-30 -59.79 -36.09 75.99 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.212 -0.449 . . . . 75.11 110.897 -179.794 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.656 HD13 ' O ' ' A' ' 19' ' ' LEU . 2.9 tm? -72.11 -21.01 61.54 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.146 -0.479 . . . . 72.51 110.876 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.406 ' HD2' ' HA ' ' A' ' 17' ' ' ASP . 1.4 ptmt -77.62 -26.56 50.65 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.219 -0.446 . . . . 74.41 110.901 179.84 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.425 ' HG3' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -83.83 -27.85 28.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.444 . . . . 74.05 110.871 -179.989 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.425 ' N ' ' HG3' ' A' ' 21' ' ' ARG . 2.7 m-85 -60.79 -22.36 64.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.196 -0.456 . . . . 74.31 110.868 -179.898 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -120.38 48.14 1.64 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.206 -0.452 . . . . 72.55 110.899 -179.845 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.1 mt 70.68 -72.01 0.12 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.114 -0.494 . . . . 75.43 110.926 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -177.78 103.87 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.233 -0.44 . . . . 71.41 110.932 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -102.79 94.8 5.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.137 -0.483 . . . . 74.25 110.862 179.892 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -85.12 -20.6 30.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.138 -0.483 . . . . 62.15 110.832 -179.778 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.24 -11.26 60.65 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.18 -0.464 . . . . 74.51 110.924 -179.98 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.811 HG22 HD22 ' A' ' 35' ' ' LEU . 1.6 m -86.13 9.73 16.53 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.085 -0.507 . . . . 70.44 111.137 -179.926 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 14.4 ptmt -45.05 157.24 0.08 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.239 -0.437 . . . . 73.33 110.894 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 5.2 t30 67.31 127.4 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.208 -0.451 . . . . 64.43 110.869 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -50.48 -31.67 15.98 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.109 -0.496 . . . . 70.21 111.053 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -54.39 -34.45 61.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.226 -0.443 . . . . 35.31 110.883 -179.874 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 46.2 m -85.59 -30.23 23.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.166 -0.47 . . . . 74.02 110.858 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.811 HD22 HG22 ' A' ' 29' ' ' THR . 1.8 mm? -58.04 -36.3 72.54 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.108 -0.496 . . . . 72.52 110.922 179.919 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.64 -50.87 71.73 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.211 -0.449 . . . . 73.13 110.943 179.858 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.56 -36.76 84.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.122 -0.49 . . . . 63.32 111.103 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.494 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.7 OUTLIER -68.66 -49.75 56.62 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.181 -0.463 . . . . 72.32 110.865 -179.995 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' A' ' 35' ' ' LEU . 7.0 mt -56.44 -36.89 69.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.28 -0.418 . . . . 72.11 110.919 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.9 mttt -58.52 -45.56 88.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.146 -0.479 . . . . 62.43 110.878 179.856 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.494 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 2.3 pt-20 -60.43 -32.58 71.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.254 -0.43 . . . . 75.11 110.919 179.931 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.3 tmt? -68.25 -34.36 76.05 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.12 -0.491 . . . . 63.43 110.914 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.784 ' OE1' HD11 ' A' ' 48' ' ' LEU . 6.8 mm-40 -57.14 -39.64 75.6 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.265 -0.425 . . . . 74.45 110.952 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.4 mmpt? -69.9 -28.27 65.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.137 -0.483 . . . . 71.43 110.947 179.9 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 43.6 t80 -70.37 -37.56 74.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.175 -0.466 . . . . 73.32 110.895 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.722 ' HB3' HD23 ' A' ' 48' ' ' LEU . 3.0 m-85 -81.84 -35.04 29.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.158 -0.474 . . . . 70.43 110.898 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.42 ' HA2' ' HB3' ' A' ' 206' ' ' SER . . . 106.06 -10.27 43.84 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.804 -0.712 . . . . 64.34 112.478 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.784 HD11 ' OE1' ' A' ' 43' ' ' GLN . 0.8 OUTLIER -65.68 139.11 96.91 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.603 0.716 . . . . 64.11 110.931 -179.937 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.462 ' HG2' HD13 ' A' ' 50' ' ' ILE . 54.4 Cg_endo -69.72 -51.98 0.36 Allowed 'Trans proline' 0 C--O 1.232 0.22 0 C-N-CA 122.67 2.246 . . . . 74.5 112.329 179.833 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.488 ' O ' HD12 ' A' ' 48' ' ' LEU . 0.0 OUTLIER -53.01 108.15 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.223 -0.444 . . . . 71.22 111.133 179.962 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.404 ' HA ' ' HG3' ' A' ' 43' ' ' GLN . 3.7 t -119.75 155.96 31.47 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.178 -0.465 . . . . 73.25 111.109 179.984 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.54 -7.58 57.39 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.774 -0.727 . . . . 64.24 112.435 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 15.3 mtt -135.1 161.17 36.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.789 0.328 . . . . 75.23 110.853 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.422 ' HA ' ' HB ' ' A' ' 58' ' ' VAL . 2.8 pp -156.59 128.97 7.53 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.169 -0.469 . . . . 73.4 110.941 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.438 ' HB2' ' HB2' ' A' ' 4' ' ' ALA . 0.5 OUTLIER 176.2 -30.31 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 44.35 110.852 179.978 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 20.4 p -93.51 -88.48 0.23 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.218 -0.446 . . . . 75.25 110.821 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 2.9 mmm180 -84.71 -35.55 22.44 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.131 -0.486 . . . . 61.22 110.832 -179.889 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.422 ' HB ' ' HA ' ' A' ' 54' ' ' LEU . 16.6 t -60.64 -43.71 95.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.169 -0.469 . . . . 70.12 111.122 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -74.82 -31.25 25.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.244 -0.434 . . . . 74.43 111.155 179.951 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -67.17 -44.13 80.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.132 -0.485 . . . . 73.45 110.982 179.87 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.562 HD12 ' CZ ' ' A' ' 46' ' ' PHE . 37.3 pt -66.89 -30.06 48.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.184 -0.462 . . . . 74.52 111.107 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -58.47 -40.67 83.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.181 -0.463 . . . . 74.01 110.893 179.888 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 16.0 pt20 -91.66 -23.94 19.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.29 -0.414 . . . . 42.22 110.905 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 4.2 ttmm -78.8 114.43 43.79 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.549 0.69 . . . . 65.34 110.906 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.85 140.22 41.82 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.668 2.246 . . . . 72.11 112.268 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.561 ' O ' HD23 ' A' ' 156' ' ' LEU . 1.0 OUTLIER -140.78 -61.69 0.49 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.157 -0.474 . . . . 71.51 110.873 -179.961 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -145.46 151.17 37.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.157 -0.474 . . . . 55.3 110.848 -179.93 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.545 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -109.51 24.27 20.46 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.677 -0.773 . . . . 64.23 112.437 -179.943 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.616 HG12 ' HD2' ' A' ' 70' ' ' PRO . 0.2 OUTLIER -103.17 137.51 19.28 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.527 0.68 . . . . 74.23 111.177 -179.978 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.616 ' HD2' HG12 ' A' ' 69' ' ' VAL . 53.9 Cg_endo -69.69 141.92 46.84 Favored 'Trans proline' 0 N--CA 1.465 -0.152 0 C-N-CA 122.721 2.281 . . . . 63.44 112.33 179.948 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -94.78 22.67 6.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.47 . . . . 74.45 110.908 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -125.62 129.16 72.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.141 -0.481 . . . . 53.43 111.092 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -131.1 170.58 14.34 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.186 -0.461 . . . . 73.13 111.103 179.874 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -179.88 164.95 1.23 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.183 -0.462 . . . . 73.31 110.83 -179.986 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 7.0 p90 -50.44 97.1 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.165 -0.471 . . . . 70.41 110.879 -179.855 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 58.4 m -163.98 179.72 6.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.198 -0.455 . . . . 74.2 110.838 -179.848 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.66 ' O ' ' CB ' ' A' ' 78' ' ' PHE . 9.5 mt 74.29 -53.33 0.68 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.144 -0.48 . . . . 70.34 110.981 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' PHE . . . . . 0.66 ' CB ' ' O ' ' A' ' 77' ' ' LEU . 1.6 m-30 147.31 -59.21 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.256 0 CA-C-O 121.705 0.764 . . . . 71.24 110.89 179.938 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.51 ' HD2' ' N ' ' A' ' 78' ' ' PHE . 53.0 Cg_endo -69.77 -174.96 1.01 Allowed 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.636 2.224 . . . . 73.34 112.338 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -176.52 97.1 0.05 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.277 -0.419 . . . . 74.43 110.91 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.7 p -167.14 155.76 9.15 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-O 121.648 0.737 . . . . 70.4 110.838 -179.878 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.401 ' HB2' ' HD3' ' A' ' 83' ' ' LYS . 53.9 Cg_endo -69.75 -49.27 0.58 Allowed 'Trans proline' 0 C--O 1.231 0.175 0 C-N-CA 122.708 2.272 . . . . 71.11 112.302 -179.959 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.742 ' CD ' HD22 ' A' ' 237' ' ' LEU . 0.0 OUTLIER -132.38 -172.18 2.83 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.182 -0.463 . . . . 64.45 110.909 179.931 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 84' ' ' TRP . . . . . 0.428 ' CE2' ' HB3' ' A' ' 162' ' ' PRO . 61.0 m95 -64.68 140.32 58.86 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.255 -0.43 . . . . 73.31 110.915 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.15 -2.29 12.78 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.236 -0.438 . . . . 65.3 111.184 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.6 m -72.52 -178.87 2.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.134 -0.485 . . . . 70.34 110.872 -179.883 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.92 -15.98 18.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.121 -0.49 . . . . 71.12 110.882 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -155.67 143.37 11.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.243 -0.435 . . . . 74.14 111.176 179.871 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 6.5 t -118.92 130.26 73.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.2 -0.455 . . . . 72.25 111.132 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.63 HG22 ' HB3' ' A' ' 125' ' ' ARG . 21.9 p -119.88 165.92 13.98 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.161 -0.472 . . . . 71.01 111.149 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 3.1 p90 -151.45 146.48 25.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.211 -0.449 . . . . 70.51 110.901 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 4.0 ttt180 -149.17 131.68 15.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.142 -0.481 . . . . 71.25 110.852 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.562 HG23 ' O ' ' A' ' 136' ' ' ILE . 5.0 mp -75.27 132.87 32.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.132 -0.485 . . . . 72.4 111.162 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.431 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 22.0 t -84.99 -40.29 14.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.166 -0.47 . . . . 60.2 111.111 179.897 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 84.5 p -159.15 169.41 24.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.15 -0.477 . . . . 64.24 110.889 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 12.6 p90 -123.61 155.15 38.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.126 -0.488 . . . . 72.25 110.932 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 5.3 t -94.12 141.19 28.83 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.144 -0.48 . . . . 64.11 111.16 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.7 -18.7 1.94 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.236 -0.438 . . . . 72.14 110.894 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.25 -36.93 85.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.169 -0.468 . . . . 74.13 110.818 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.704 HD22 HG21 ' A' ' 104' ' ' THR . 1.2 mt -140.15 153.47 69.16 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.54 0.686 . . . . 72.52 110.952 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 101' ' ' PRO . . . . . 0.567 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.4 Cg_endo -69.81 150.98 68.63 Favored 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.629 2.219 . . . . 73.11 112.324 179.887 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 12.7 t-160 -52.22 -27.89 16.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.164 -0.471 . . . . 74.11 110.919 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.567 HG22 ' HB2' ' A' ' 101' ' ' PRO . 0.0 OUTLIER -75.03 -39.17 43.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.218 -0.446 . . . . 74.02 111.126 -179.992 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 104' ' ' THR . . . . . 0.704 HG21 HD22 ' A' ' 100' ' ' LEU . 3.0 m -69.66 -39.11 77.25 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.157 -0.474 . . . . 52.11 111.14 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.777 ' O ' HG13 ' A' ' 109' ' ' VAL . 76.5 t -72.83 -46.22 53.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.187 -0.461 . . . . 71.51 111.11 179.93 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.683 ' O ' HG22 ' A' ' 109' ' ' VAL . 0.3 OUTLIER -60.74 -44.17 97.01 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.147 -0.479 . . . . 63.44 110.814 179.987 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 11.2 ptm180 -70.16 -34.11 72.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.198 -0.456 . . . . 75.02 110.838 -179.856 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.647 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -61.15 -48.26 82.4 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.17 -0.468 . . . . 71.04 110.877 -179.968 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.777 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.5 m -55.4 -41.61 63.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.244 -0.435 . . . . 72.31 111.087 179.846 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.469 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 10.7 t -70.11 -33.51 71.93 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.16 -0.473 . . . . 72.14 110.878 -179.847 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.43 ' HB3' HD21 ' A' ' 189' ' ' LEU . 0.4 OUTLIER -61.47 -32.86 72.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.105 -0.498 . . . . 74.35 110.957 179.931 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -97.14 -40.47 8.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.196 -0.457 . . . . 74.32 111.144 179.783 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.712 HD12 HD12 ' A' ' 196' ' ' LEU . 0.4 OUTLIER -65.38 -33.88 77.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.206 -0.452 . . . . 72.0 110.956 -180.0 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 36.7 t-20 -67.55 -35.71 79.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.177 -0.465 . . . . 72.34 110.812 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' MET . . . . . 0.908 ' HB3' HD23 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -68.25 -33.6 74.67 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.226 -0.443 . . . . 54.12 110.89 179.888 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 6.0 m95 -68.55 -44.91 73.51 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.225 -0.443 . . . . 75.23 110.966 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -73.38 -40.43 48.45 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.695 -0.764 . . . . 73.32 112.532 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.416 ' HG2' ' O ' ' A' ' 115' ' ' MET . 4.5 ptpt -60.76 -16.93 45.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.709 0.29 . . . . 72.42 110.897 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.667 ' HB3' HG23 ' A' ' 231' ' ' ILE . 27.9 mm-40 -98.26 13.51 31.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.205 -0.452 . . . . 75.24 110.902 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.988 HD12 HD12 ' A' ' 122' ' ' LEU . 6.1 pt -147.64 150.31 36.31 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.561 0.696 . . . . 71.34 111.162 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.85 6.75 1.22 Allowed 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.662 2.242 . . . . 72.21 112.326 179.901 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.988 HD12 HD12 ' A' ' 120' ' ' ILE . 10.2 mt -60.2 -160.37 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.259 -0.428 . . . . 73.22 110.882 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 4.6 t-80 -154.31 121.29 5.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.199 -0.455 . . . . 74.12 110.848 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 10.0 m-30 -109.33 148.74 30.55 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.173 -0.467 . . . . 75.54 110.899 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.63 ' HB3' HG22 ' A' ' 90' ' ' THR . 0.1 OUTLIER -130.69 141.73 50.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.146 -0.479 . . . . 75.14 110.827 -179.884 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 126' ' ' LYS . . . . . 0.522 ' HE3' HG13 ' A' ' 128' ' ' VAL . 0.1 OUTLIER -80.93 147.5 30.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.148 -0.478 . . . . 72.22 110.911 179.928 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 127' ' ' VAL . . . . . 1.048 HG11 ' HB2' ' A' ' 132' ' ' ALA . 29.9 m -103.08 126.3 57.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.258 -0.428 . . . . 50.13 111.145 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.602 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -142.45 -10.3 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.12 -0.491 . . . . 74.43 111.17 179.854 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 129' ' ' TRP . . . . . 0.602 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -154.87 109.17 2.96 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.132 -0.486 . . . . 71.25 110.905 179.979 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.68 -159.72 14.33 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.722 -0.752 . . . . 62.11 112.457 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.3 p -101.82 156.33 17.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.852 0.358 . . . . 63.25 111.11 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 132' ' ' ALA . . . . . 1.048 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -111.61 165.26 12.17 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.176 -0.465 . . . . 51.34 111.053 179.915 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.06 -62.54 1.36 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.225 -0.443 . . . . 75.41 110.817 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 134' ' ' ILE . . . . . 0.435 HD12 ' O ' ' A' ' 90' ' ' THR . 4.6 mp -88.68 122.53 40.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 70.51 111.167 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 135' ' ' MET . . . . . 0.431 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 14.3 mmm -100.58 125.79 46.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.149 -0.478 . . . . 72.43 110.829 179.882 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.562 ' O ' HG23 ' A' ' 93' ' ' ILE . 0.9 OUTLIER -105.92 94.97 3.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.165 -0.47 . . . . 70.04 111.113 179.989 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -129.7 167.71 21.43 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.742 -0.742 . . . . 63.34 112.462 179.922 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 138' ' ' PHE . . . . . 0.563 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 55.3 m-85 -105.1 145.47 30.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.849 0.357 . . . . 74.01 110.913 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.563 ' HB2' ' O ' ' A' ' 138' ' ' PHE . . . 169.72 166.11 0.05 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.12 -0.491 . . . . 71.21 111.102 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.434 ' HB2' ' HB3' ' A' ' 149' ' ' PHE . 0.0 OUTLIER -107.94 174.21 5.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.262 -0.426 . . . . 62.21 110.819 -179.926 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 141' ' ' GLY . . . . . 0.555 ' H ' ' HA ' ' A' ' 149' ' ' PHE . . . -55.67 -16.44 11.44 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.753 -0.737 . . . . 74.24 112.471 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 142' ' ' ALA . . . . . 0.531 ' HB2' ' HD2' ' A' ' 149' ' ' PHE . . . -94.12 13.12 24.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.828 0.347 . . . . 75.03 111.113 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 143' ' ' HIS . . . . . 0.556 ' CB ' ' HB1' ' A' ' 139' ' ' ALA . 3.2 p80 -79.42 -4.48 51.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.202 -0.453 . . . . 71.11 110.867 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 110.77 48.13 0.75 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.69 -0.767 . . . . 45.51 112.46 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -161.79 175.11 12.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.9 0.381 . . . . 72.14 110.818 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 69.9 p -63.81 175.22 1.19 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.154 -0.476 . . . . 51.25 110.862 -179.762 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 64.52 118.93 0.02 OUTLIER Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.743 0.782 . . . . 73.4 110.876 -179.882 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.72 151.18 69.26 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.654 2.236 . . . . 74.53 112.325 179.901 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 149' ' ' PHE . . . . . 0.555 ' HA ' ' H ' ' A' ' 141' ' ' GLY . 3.6 p90 -54.23 -38.38 65.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.231 -0.44 . . . . 63.52 110.844 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 150' ' ' ASP . . . . . 0.492 ' CG ' ' O ' ' A' ' 149' ' ' PHE . 2.7 p30 48.72 18.46 0.19 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.166 -0.47 . . . . 63.11 110.858 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 151' ' ' GLY . . . . . 0.42 ' C ' ' O ' ' A' ' 150' ' ' ASP . . . 36.44 -150.29 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.767 -0.73 . . . . 71.41 112.434 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.72 144.66 54.93 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.709 2.273 . . . . 75.11 112.289 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 153' ' ' GLY . . . . . 0.449 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 106.04 -138.14 14.18 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.737 -0.744 . . . . 70.32 112.447 179.904 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 154' ' ' ASN . . . . . 0.449 ' C ' ' O ' ' A' ' 153' ' ' GLY . 3.6 p30 -34.2 136.37 0.13 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.882 0.373 . . . . 73.25 110.881 -179.856 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 155' ' ' THR . . . . . 0.419 HG22 ' HA3' ' A' ' 68' ' ' GLY . 0.2 OUTLIER 75.56 110.56 0.07 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.185 -0.461 . . . . 44.41 111.15 179.992 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 156' ' ' LEU . . . . . 0.932 HD21 HG21 ' A' ' 186' ' ' ILE . 0.4 OUTLIER -91.17 -54.32 3.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.222 -0.445 . . . . 75.02 110.896 -179.979 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 157' ' ' ALA . . . . . 0.545 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -163.85 148.95 10.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.22 -0.446 . . . . 71.42 111.022 179.794 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 158' ' ' HIS . . . . . 0.415 ' O ' ' HB2' ' A' ' 171' ' ' HIS . 14.5 p-80 -107.54 125.38 51.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.155 -0.475 . . . . 72.02 110.908 179.943 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -110.54 155.09 22.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.229 -0.441 . . . . 74.42 111.1 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 16.7 m-85 -106.86 151.95 24.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.246 -0.434 . . . . 75.31 110.867 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 161' ' ' ALA . . . . . 0.713 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -78.52 164.75 54.29 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.626 0.727 . . . . 61.04 111.046 179.925 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 162' ' ' PRO . . . . . 0.713 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.2 Cg_endo -69.83 78.48 1.03 Allowed 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.688 2.259 . . . . 74.44 112.257 -179.956 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 163' ' ' GLY . . . . . 0.478 ' HA3' ' HG3' ' A' ' 79' ' ' PRO . . . -130.45 119.87 2.87 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.73 -0.748 . . . . 61.41 112.422 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 50.85 -169.86 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.874 0.369 . . . . 73.1 111.101 -179.896 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -75.51 -54.57 5.45 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.752 -0.737 . . . . 74.03 112.508 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 166' ' ' LEU . . . . . 0.438 ' C ' HD23 ' A' ' 166' ' ' LEU . 10.1 tt -54.36 -40.15 67.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.863 0.364 . . . . 65.12 110.895 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -80.22 164.04 47.47 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.742 -0.742 . . . . 43.43 112.512 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 168' ' ' GLY . . . . . 0.403 ' O ' HG13 ' A' ' 134' ' ' ILE . . . 84.54 23.11 51.88 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.815 -0.707 . . . . 74.31 112.515 -179.85 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -91.3 163.52 14.19 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.736 0.303 . . . . 63.41 110.89 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.49 130.95 55.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.225 -0.443 . . . . 74.21 111.061 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 171' ' ' HIS . . . . . 0.415 ' HB2' ' O ' ' A' ' 158' ' ' HIS . 27.3 m170 -125.1 158.55 33.58 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 72.53 110.831 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 64.0 m-85 -142.26 137.37 30.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.251 -0.432 . . . . 71.44 110.904 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 55.2 t0 -69.08 99.23 1.07 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 74.11 110.82 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.58 -16.41 10.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.152 -0.476 . . . . 72.25 110.879 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -77.86 -16.32 58.37 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.163 -0.472 . . . . 73.32 110.783 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 23.6 mm-40 -83.38 -175.65 5.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.241 -0.436 . . . . 63.2 110.898 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 1.9 mtt180 -109.8 116.79 32.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.143 -0.481 . . . . 63.14 110.917 -179.888 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 51.0 m95 -116.61 141.18 48.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.253 -0.43 . . . . 72.31 110.919 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 179' ' ' THR . . . . . 0.645 ' HA ' HD11 ' A' ' 100' ' ' LEU . 2.0 t -177.61 164.36 2.02 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.19 -0.459 . . . . 74.13 111.129 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -124.59 -68.76 0.84 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.213 -0.449 . . . . 45.33 110.881 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -70.51 -10.88 67.54 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.712 -0.756 . . . . 62.41 112.501 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 182' ' ' SER . . . . . 0.483 ' O ' ' C ' ' A' ' 183' ' ' SER . 0.2 OUTLIER -97.01 -24.29 15.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.878 0.37 . . . . 64.5 110.84 -179.723 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 183' ' ' SER . . . . . 0.483 ' C ' ' O ' ' A' ' 182' ' ' SER . 7.4 p 31.84 71.56 0.08 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.172 -0.467 . . . . 64.12 110.854 -179.877 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 184' ' ' LEU . . . . . 0.42 HD23 ' CG2' ' A' ' 179' ' ' THR . 0.5 OUTLIER -117.09 -32.64 4.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.215 -0.448 . . . . 74.2 110.895 179.987 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -132.28 -127.23 2.8 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.812 -0.708 . . . . 73.01 112.529 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 186' ' ' ILE . . . . . 0.932 HG21 HD21 ' A' ' 156' ' ' LEU . 6.7 mm -79.53 99.81 3.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.823 0.344 . . . . 73.22 111.147 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -55.96 125.65 22.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.173 -0.467 . . . . 71.31 110.824 179.946 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 188' ' ' PHE . . . . . 0.722 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.1 t80 -53.85 -33.28 55.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.185 -0.461 . . . . 75.45 110.863 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 189' ' ' LEU . . . . . 0.43 HD21 ' HB3' ' A' ' 111' ' ' LYS . 0.2 OUTLIER -67.21 -47.62 70.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.193 -0.458 . . . . 52.02 110.907 -179.981 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 10.1 m-30 -69.98 -40.15 75.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.228 -0.442 . . . . 74.22 110.908 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 191' ' ' ALA . . . . . 0.568 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -70.22 -35.8 74.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.119 -0.491 . . . . 50.03 111.061 179.919 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 192' ' ' ALA . . . . . 0.714 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -56.93 -44.66 82.69 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.26 -0.427 . . . . 52.11 111.132 179.914 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.07 -41.51 83.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.207 -0.451 . . . . 72.43 111.164 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 5.0 t-160 -72.81 -41.73 64.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 71.44 110.844 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -71.56 -48.42 48.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.164 -0.471 . . . . 71.01 111.142 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 196' ' ' LEU . . . . . 0.714 HD23 ' O ' ' A' ' 192' ' ' ALA . 4.3 mm? -64.66 -42.02 95.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.232 -0.44 . . . . 74.51 110.885 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -60.11 -29.04 67.48 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.784 -0.722 . . . . 52.23 112.438 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 198' ' ' HIS . . . . . 0.61 ' CD2' HG21 ' A' ' 69' ' ' VAL . 6.1 m-70 -69.19 -33.95 74.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.876 0.37 . . . . 75.21 110.947 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -68.92 -21.37 64.22 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.179 -0.464 . . . . 71.13 110.818 -179.794 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 200' ' ' LEU . . . . . 0.418 ' HB2' ' HG2' ' A' ' 202' ' ' MET . 0.5 OUTLIER -88.0 -1.05 57.75 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.155 -0.475 . . . . 64.13 110.913 -179.974 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 84.3 8.97 82.75 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.721 -0.752 . . . . 50.41 112.501 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 202' ' ' MET . . . . . 0.657 ' SD ' HD12 ' A' ' 234' ' ' ILE . 97.3 mmm -71.19 159.27 34.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.885 0.374 . . . . 63.21 110.882 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -125.94 159.18 20.34 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.682 -0.77 . . . . 64.44 112.45 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 16.4 m-70 -50.67 161.05 0.37 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.842 0.354 . . . . 74.32 110.873 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -123.16 150.47 43.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.199 -0.455 . . . . 53.34 110.915 -179.832 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 206' ' ' SER . . . . . 0.42 ' HB3' ' HA2' ' A' ' 47' ' ' GLY . 0.9 OUTLIER -87.63 -4.67 58.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.154 -0.475 . . . . 72.22 110.864 -179.817 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.55 137.96 83.41 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 121.557 0.694 . . . . 65.11 110.859 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 -7.23 20.54 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.699 2.266 . . . . 74.53 112.317 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 -128.97 30.78 5.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.24 -0.436 . . . . 63.52 110.9 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -87.11 145.7 26.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.129 -0.487 . . . . 62.23 111.149 179.904 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -67.77 -27.72 39.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.231 -0.44 . . . . 62.04 111.109 -179.958 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 81.1 mtp -97.1 8.58 44.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.167 -0.47 . . . . 75.22 110.906 179.931 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 213' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -55.89 114.16 6.99 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.695 0.759 . . . . 73.43 110.913 -179.887 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -69.72 -17.95 37.49 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.658 2.239 . . . . 63.01 112.372 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 215' ' ' THR . . . . . 0.488 HG23 HG21 ' A' ' 61' ' ' ILE . 0.3 OUTLIER -83.98 60.22 5.72 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.2 -0.454 . . . . 74.24 111.103 -179.935 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -47.51 122.75 5.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.968 0.413 . . . . 74.14 110.939 -179.933 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -131.83 -163.44 10.78 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.795 -0.717 . . . . 74.22 112.53 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 5.5 p30 -98.68 -168.15 1.6 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.905 0.383 . . . . 64.22 110.867 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . 60.04 76.77 0.21 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.742 -0.742 . . . . 72.24 112.507 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 220' ' ' ASP . . . . . . . . . . . . . 7.1 p30 -120.28 153.95 56.02 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-O 121.61 0.719 . . . . 41.43 110.845 -179.95 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 221' ' ' PRO . . . . . 0.432 ' HG2' ' HB2' ' A' ' 224' ' ' PHE . 53.0 Cg_endo -69.81 168.77 20.66 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.721 2.281 . . . . 73.42 112.337 -179.929 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.09 -25.69 34.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.258 -0.428 . . . . 74.21 110.885 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 -109.56 -41.67 4.52 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.258 -0.428 . . . . 60.33 110.934 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 224' ' ' PHE . . . . . 0.432 ' HB2' ' HG2' ' A' ' 221' ' ' PRO . 8.1 t80 61.62 132.12 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.142 -0.481 . . . . 65.01 110.861 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.3 -176.87 5.2 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.137 -0.483 . . . . 64.24 110.84 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 226' ' ' LEU . . . . . 0.908 HD23 ' HB3' ' A' ' 115' ' ' MET . 0.7 OUTLIER -59.7 149.12 31.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.204 -0.453 . . . . 53.44 110.97 179.935 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 227' ' ' SER . . . . . 0.411 ' O ' HD12 ' A' ' 231' ' ' ILE . 2.3 t -86.4 160.43 19.06 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.285 -0.416 . . . . 74.21 110.911 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -63.29 -64.94 0.76 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.134 -0.485 . . . . 74.54 110.925 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -55.58 -26.55 44.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.204 -0.453 . . . . 72.22 110.822 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.36 -48.63 60.69 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.314 -0.403 . . . . 74.23 110.865 -179.934 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 231' ' ' ILE . . . . . 0.667 HG23 ' HB3' ' A' ' 119' ' ' GLU . 7.6 mt -69.06 -42.92 82.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.243 -0.435 . . . . 73.41 111.168 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.57 -32.13 73.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.167 -0.47 . . . . 65.42 110.919 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -63.1 -49.0 75.31 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.749 -0.738 . . . . 63.43 112.472 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 234' ' ' ILE . . . . . 0.657 HD12 ' SD ' ' A' ' 202' ' ' MET . 7.3 tt -72.97 -32.45 39.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.759 0.314 . . . . 71.54 111.11 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -70.12 -24.52 63.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.21 -0.45 . . . . 70.33 110.968 179.914 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 236' ' ' LYS . . . . . 0.431 ' HE2' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.32 -27.58 60.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.169 -0.469 . . . . 51.21 110.879 -179.991 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 237' ' ' LEU . . . . . 0.742 HD22 ' CD ' ' A' ' 83' ' ' LYS . 3.8 tt -97.78 -26.74 14.61 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.241 -0.436 . . . . 75.41 110.907 179.938 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 238' ' ' TYR . . . . . 0.449 ' OH ' HD11 ' A' ' 122' ' ' LEU . 4.4 m-85 -91.96 -35.2 14.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.194 -0.457 . . . . 51.24 110.985 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -142.85 -119.16 1.41 Allowed Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.794 -0.717 . . . . 32.22 112.499 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 31.8 tttm -87.9 149.74 23.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.749 0.309 . . . . 75.42 110.946 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 6.0 ptm180 -91.19 -173.59 3.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.215 -0.448 . . . . 73.34 110.903 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 40.3 t -146.75 -45.03 0.18 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.273 -0.421 . . . . 62.42 110.866 -179.843 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -164.55 -176.16 4.2 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.159 -0.473 . . . . 72.13 110.903 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -106.51 117.13 33.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.24 -0.437 . . . . 62.23 110.864 -179.844 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -172.86 -179.66 2.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.184 -0.462 . . . . 70.43 110.871 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 2.5 tttm 59.74 83.04 0.14 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.224 -0.443 . . . . 72.11 110.851 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.232 -0.44 . . . . 74.13 110.826 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 302' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' -2' ' ' LEU . . . . . . . . . . . . . 1.3 mp . . . . . 0 C--O 1.231 0.123 0 CA-C-O 121.618 0.723 . . . . 73.02 110.952 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' -1' ' ' PRO . . . . . 0.513 ' O ' HD12 ' A' ' 0' ' ' LEU . 54.6 Cg_endo -69.8 176.4 6.85 Favored 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.713 2.275 . . . . 71.15 112.35 179.815 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 0' ' ' LEU . . . . . 0.513 HD12 ' O ' ' A' ' -1' ' ' PRO . 0.2 OUTLIER -160.64 160.64 25.57 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.567 0.698 . . . . 62.13 110.92 -179.986 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.75 -170.97 0.43 Allowed 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.713 2.275 . . . . 64.14 112.4 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -118.8 79.43 1.39 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.288 -0.414 . . . . 60.51 110.867 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -95.19 -23.48 17.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.247 -0.433 . . . . 74.01 110.901 -179.946 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.45 -33.85 66.28 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.149 -0.478 . . . . 71.4 111.158 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -56.15 -34.18 62.14 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.755 -0.736 . . . . 60.51 112.486 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -108.93 21.57 27.19 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.647 -0.787 . . . . 54.22 112.545 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.83 164.13 24.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.784 0.326 . . . . 72.23 110.876 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -83.1 168.69 16.64 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.459 . . . . 73.24 110.852 -179.777 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.431 ' HG3' HD22 ' A' ' 10' ' ' LEU . 15.3 pt-20 -58.84 -32.03 69.05 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.146 -0.479 . . . . 50.12 110.858 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.431 HD22 ' HG3' ' A' ' 9' ' ' GLU . 4.1 mm? -64.19 -42.8 96.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.156 -0.475 . . . . 72.33 110.979 179.973 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -68.53 -38.56 80.96 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.178 -0.465 . . . . 72.14 110.922 179.933 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 50.3 t-105 -73.06 -33.45 65.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 71.22 110.983 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -58.88 -35.62 73.29 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.202 -0.454 . . . . 72.51 110.884 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.09 -36.64 84.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.185 -0.461 . . . . 61.24 110.857 -179.863 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.1 -42.4 80.69 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.251 -0.432 . . . . 54.34 111.138 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.569 ' OE1' HD12 ' A' ' 35' ' ' LEU . 1.7 tt0 -73.07 -43.03 62.41 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.187 -0.46 . . . . 73.12 110.927 -179.926 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -61.63 -32.44 72.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.243 -0.435 . . . . 72.4 110.938 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 8.5 m-85 -70.38 -37.07 74.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.15 -0.477 . . . . 75.11 110.953 -179.853 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.617 HD13 ' O ' ' A' ' 19' ' ' LEU . 3.0 tm? -71.73 -24.54 61.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.108 -0.496 . . . . 72.51 110.869 179.975 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.441 ' HE2' ' HA ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -72.23 -42.36 65.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.238 -0.437 . . . . 74.41 110.918 179.801 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.441 ' HA ' ' HE2' ' A' ' 20' ' ' LYS . 3.2 ptm180 -67.93 -28.19 67.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.19 -0.459 . . . . 74.05 110.887 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.431 ' N ' ' HG3' ' A' ' 21' ' ' ARG . 2.0 m-85 -62.13 -25.09 67.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.199 -0.455 . . . . 74.31 110.86 -179.944 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -120.91 38.36 4.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.143 -0.48 . . . . 72.55 110.92 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.7 mt 70.95 -71.43 0.13 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.086 -0.506 . . . . 75.43 110.887 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -177.41 105.63 0.05 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.22 -0.445 . . . . 71.41 110.924 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -88.32 90.44 8.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.123 -0.49 . . . . 74.25 110.85 179.918 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 24.3 p -85.04 -36.21 21.4 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.151 -0.477 . . . . 62.15 110.917 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -69.9 -14.36 62.69 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.084 -0.507 . . . . 74.51 110.892 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.0 m -90.93 9.55 30.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.197 -0.456 . . . . 70.44 111.179 -179.909 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.6 108.69 1.02 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.165 -0.471 . . . . 73.33 110.849 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -179.61 153.19 0.54 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.235 -0.439 . . . . 64.43 110.895 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.28 -40.03 59.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.175 -0.466 . . . . 70.21 111.089 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 12.8 m120 -83.24 -25.42 31.68 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.254 -0.43 . . . . 35.31 110.89 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 83.7 p -58.48 -22.24 54.21 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.165 -0.47 . . . . 74.02 110.835 -179.836 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.569 HD12 ' OE1' ' A' ' 16' ' ' GLN . 0.8 OUTLIER -57.89 -43.08 85.88 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.152 -0.476 . . . . 72.52 110.921 179.997 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.473 ' N ' HD23 ' A' ' 35' ' ' LEU . 0.4 OUTLIER -63.63 -53.12 56.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.195 -0.457 . . . . 73.13 110.843 179.944 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -59.35 -49.32 78.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.156 -0.475 . . . . 63.32 111.071 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.556 ' HD3' HD12 ' A' ' 19' ' ' LEU . 33.7 tttt -59.91 -38.79 83.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.225 -0.443 . . . . 72.32 110.92 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.461 HD22 ' HG ' ' A' ' 35' ' ' LEU . 0.8 OUTLIER -67.53 -35.93 80.04 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.267 -0.424 . . . . 72.11 110.931 179.888 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 19.3 mttt -63.14 -45.17 93.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.123 -0.489 . . . . 62.43 110.951 179.849 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -69.48 -33.32 72.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.191 -0.458 . . . . 75.11 110.903 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.563 ' CE ' HD11 ' A' ' 61' ' ' ILE . 1.9 ttt -66.06 -47.66 73.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.137 -0.483 . . . . 63.43 110.922 179.971 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.693 ' HA ' HD12 ' A' ' 48' ' ' LEU . 17.4 mt-30 -58.64 -39.65 81.18 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.223 -0.444 . . . . 74.45 110.896 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.8 mmpt? -59.23 -20.57 55.19 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.248 -0.433 . . . . 71.43 110.823 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 68.8 t80 -70.42 -46.3 64.2 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.274 -0.421 . . . . 73.32 110.817 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.625 ' CE1' HD12 ' A' ' 61' ' ' ILE . 36.1 m-85 -81.82 -3.78 54.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.175 -0.466 . . . . 70.43 110.888 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.45 12.49 84.49 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.689 -0.767 . . . . 64.34 112.475 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.693 HD12 ' HA ' ' A' ' 43' ' ' GLN . 0.3 OUTLIER -59.73 140.58 89.45 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.568 0.699 . . . . 64.11 110.941 -179.936 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.8 -53.29 0.28 Allowed 'Trans proline' 0 C--O 1.231 0.159 0 C-N-CA 122.72 2.28 . . . . 74.5 112.318 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.545 HD11 ' HB3' ' A' ' 48' ' ' LEU . 0.8 OUTLIER -53.33 139.25 11.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 71.22 111.032 179.969 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -129.63 126.94 39.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.133 -0.485 . . . . 73.25 111.174 179.877 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 85.07 5.69 85.62 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.735 -0.745 . . . . 64.24 112.509 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -135.05 154.63 51.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.829 0.347 . . . . 75.23 110.864 -179.942 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.428 HD23 ' CD2' ' A' ' 39' ' ' LEU . 2.8 pp -159.16 130.23 6.11 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.203 -0.453 . . . . 73.4 110.955 179.966 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 173.96 -24.38 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.132 -0.486 . . . . 44.35 110.898 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -104.09 -81.27 0.52 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 75.25 110.912 -179.888 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.672 ' O ' HG23 ' A' ' 61' ' ' ILE . 0.1 OUTLIER -84.3 -45.55 12.71 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.161 -0.472 . . . . 61.22 110.954 179.974 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.525 HG22 HD13 ' A' ' 48' ' ' LEU . 41.3 t -57.14 -45.69 84.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.124 -0.489 . . . . 70.12 111.129 179.94 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.423 HD13 ' HB2' ' A' ' 62' ' ' MET . 0.2 OUTLIER -74.63 -30.45 25.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.163 -0.472 . . . . 74.43 111.105 179.989 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -59.62 -40.47 87.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.174 -0.466 . . . . 73.45 110.832 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.672 HG23 ' O ' ' A' ' 57' ' ' ARG . 0.5 OUTLIER -68.43 -29.43 44.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.156 -0.474 . . . . 74.52 111.115 -179.968 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.423 ' HB2' HD13 ' A' ' 59' ' ' ILE . 6.9 mtt -65.19 -32.68 74.48 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.161 -0.472 . . . . 74.01 110.932 179.775 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -100.66 -26.48 13.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.16 -0.473 . . . . 42.22 110.913 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.35 119.01 71.89 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.52 0.676 . . . . 65.34 110.932 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.71 143.36 50.83 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.706 2.271 . . . . 72.11 112.33 179.889 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 2.0 ppt_? -155.73 -53.73 0.09 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.192 -0.458 . . . . 71.51 110.882 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 6.4 t -139.42 123.88 18.23 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.163 -0.471 . . . . 55.3 110.928 -179.944 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.534 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -79.33 -36.91 25.81 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.747 -0.739 . . . . 64.23 112.462 -179.888 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.673 HG21 ' O ' ' A' ' 159' ' ' ALA . 1.1 t -64.71 146.45 98.45 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-O 121.592 0.71 . . . . 74.23 111.209 -179.988 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.515 ' HD2' HG22 ' A' ' 69' ' ' VAL . 52.9 Cg_endo -69.81 159.85 51.84 Favored 'Trans proline' 0 C--O 1.231 0.166 0 C-N-CA 122.675 2.25 . . . . 63.44 112.302 -180.0 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -85.0 -0.29 53.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.219 -0.446 . . . . 74.45 110.876 179.925 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.9 m -103.56 128.56 56.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.199 -0.455 . . . . 53.43 111.095 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -131.13 170.64 14.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.176 -0.466 . . . . 73.13 111.108 179.825 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -130.47 134.64 47.25 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.204 -0.453 . . . . 73.31 110.921 -179.955 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 39.4 p90 -48.92 121.84 5.14 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.213 -0.448 . . . . 70.41 110.839 -179.789 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -56.42 179.1 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.101 -0.5 . . . . 74.2 110.829 -179.862 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -137.31 -61.95 0.63 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.136 -0.484 . . . . 70.34 110.911 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' PHE . . . . . 0.565 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 0.1 OUTLIER -75.08 -55.94 2.14 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.654 0.74 . . . . 71.24 110.926 179.914 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.565 ' HD2' ' N ' ' A' ' 78' ' ' PHE . 52.9 Cg_endo -69.78 114.94 3.87 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.714 2.276 . . . . 73.34 112.324 -179.974 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 8.0 m-20 -54.71 104.05 0.1 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.216 -0.447 . . . . 74.43 110.911 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 65.03 160.15 0.12 Allowed Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.654 0.74 . . . . 70.4 110.871 -179.839 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 -23.08 31.12 Favored 'Trans proline' 0 C--O 1.232 0.195 0 C-N-CA 122.688 2.259 . . . . 71.11 112.316 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.764 ' HD2' HD13 ' A' ' 237' ' ' LEU . 4.2 mtpt -88.98 150.72 22.68 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.229 -0.441 . . . . 64.45 110.906 179.928 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' TRP . . . . . 0.414 ' CH2' ' HB3' ' A' ' 162' ' ' PRO . 95.6 m95 -50.96 132.54 27.24 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.324 -0.398 . . . . 73.31 110.935 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -114.48 -10.66 12.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.307 -0.406 . . . . 65.3 111.147 -179.916 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -64.85 -176.77 0.29 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.241 -0.436 . . . . 70.34 110.909 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 9.7 mptt -99.39 -11.14 21.43 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.116 -0.493 . . . . 71.12 110.885 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -156.19 142.1 10.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.172 -0.467 . . . . 74.14 111.141 179.877 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 90.5 t -118.46 130.51 73.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.101 -0.499 . . . . 72.25 111.156 179.865 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -115.95 161.57 18.64 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.202 -0.453 . . . . 71.01 111.128 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 4.6 p90 -149.37 147.16 27.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 70.51 110.88 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -150.07 138.86 20.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.103 -0.498 . . . . 71.25 110.96 -179.946 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.441 HD11 ' HA ' ' A' ' 106' ' ' ASP . 10.0 mm -78.29 133.48 30.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.24 -0.436 . . . . 72.4 111.169 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.485 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 18.8 t -86.91 -40.47 14.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.194 -0.457 . . . . 60.2 111.201 179.825 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 2.9 t -143.67 169.38 17.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.128 -0.487 . . . . 64.24 110.859 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 8.8 p90 -111.62 148.88 32.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.165 -0.47 . . . . 72.25 110.926 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.51 ' OG1' HG21 ' A' ' 105' ' ' VAL . 0.2 OUTLIER -82.91 141.05 32.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.071 -0.513 . . . . 64.11 111.134 -179.986 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 2.8 ppt_? -71.7 -8.76 56.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.209 -0.45 . . . . 72.14 110.799 -179.925 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -96.6 -25.79 15.47 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.199 -0.455 . . . . 74.13 110.876 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.468 ' O ' ' O ' ' A' ' 97' ' ' THR . 1.1 mp -137.68 152.45 72.68 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.618 0.723 . . . . 72.52 110.927 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 101' ' ' PRO . . . . . 0.599 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.9 Cg_endo -69.73 150.95 69.1 Favored 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 122.701 2.268 . . . . 73.11 112.309 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 4.7 t-160 -52.06 -25.59 9.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.455 . . . . 74.11 110.837 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.599 HG22 ' HB2' ' A' ' 101' ' ' PRO . 11.7 tt -77.26 -37.47 25.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.263 -0.426 . . . . 74.02 111.143 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 104' ' ' THR . . . . . 0.795 ' O ' HD22 ' A' ' 108' ' ' LEU . 3.4 m -68.94 -39.19 79.71 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.174 -0.467 . . . . 52.11 111.13 179.941 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.792 ' O ' HG13 ' A' ' 109' ' ' VAL . 81.1 t -71.76 -45.74 64.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.212 -0.449 . . . . 71.51 111.145 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.624 ' O ' HG22 ' A' ' 109' ' ' VAL . 16.0 t0 -62.61 -39.53 94.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.208 -0.451 . . . . 63.44 110.917 179.927 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 107' ' ' ARG . . . . . 0.499 ' HG3' ' N ' ' A' ' 108' ' ' LEU . 0.0 OUTLIER -70.57 -33.8 71.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.168 -0.469 . . . . 75.02 110.926 179.996 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.795 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -65.61 -49.56 68.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.202 -0.453 . . . . 71.04 110.934 -179.971 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.792 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.6 m -55.83 -42.93 72.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.183 -0.462 . . . . 72.31 111.059 179.877 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.489 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 44.6 t -70.2 -34.17 72.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.13 -0.487 . . . . 72.14 110.903 -179.824 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.496 ' CG ' HD21 ' A' ' 189' ' ' LEU . 0.4 OUTLIER -62.16 -33.25 74.16 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.105 -0.498 . . . . 74.35 110.942 179.878 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.43 -40.28 9.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.272 -0.422 . . . . 74.32 111.16 179.755 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.852 HD12 HD12 ' A' ' 196' ' ' LEU . 0.4 OUTLIER -65.59 -33.2 75.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 72.0 110.949 179.97 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -69.59 -44.42 70.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.15 -0.477 . . . . 72.34 110.87 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' MET . . . . . 0.492 ' O ' HD11 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -57.84 -34.86 70.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.207 -0.452 . . . . 54.12 110.843 179.936 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 5.1 m95 -62.53 -47.44 83.91 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.287 -0.415 . . . . 75.23 110.91 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 117' ' ' GLY . . . . . 0.482 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -72.97 -32.77 60.41 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.745 -0.741 . . . . 73.32 112.507 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.0 mmpt? -62.98 -14.3 45.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.842 0.353 . . . . 72.42 110.971 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.734 ' HG2' HD13 ' A' ' 226' ' ' LEU . 0.9 OUTLIER -104.65 13.71 31.07 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.112 -0.495 . . . . 75.24 110.906 179.904 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 1.063 HD12 HD12 ' A' ' 122' ' ' LEU . 5.8 pt -146.91 156.29 47.61 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.707 0.765 . . . . 71.34 111.063 -179.992 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.83 2.14 3.84 Favored 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 122.701 2.267 . . . . 72.21 112.333 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 1.063 HD12 HD12 ' A' ' 120' ' ' ILE . 7.1 mt -60.96 -157.42 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.219 -0.446 . . . . 73.22 110.892 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 30.5 t-80 -163.63 138.47 6.15 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.158 -0.474 . . . . 74.12 110.822 179.818 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' PHE . . . . . 0.469 ' CD2' HD21 ' A' ' 113' ' ' LEU . 37.3 m-85 -120.88 148.83 43.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.195 -0.457 . . . . 75.54 110.902 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.4 141.22 51.48 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.204 -0.453 . . . . 75.14 110.877 -179.879 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.51 140.04 36.07 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.219 -0.446 . . . . 72.22 110.84 179.973 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 127' ' ' VAL . . . . . 0.933 HG11 ' HB2' ' A' ' 132' ' ' ALA . 15.0 m -102.56 131.48 50.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.188 -0.46 . . . . 50.13 111.149 179.871 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.462 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -143.93 -22.33 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 74.43 111.122 179.962 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 129' ' ' TRP . . . . . 0.462 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -138.6 109.19 6.58 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.151 -0.477 . . . . 71.25 110.91 179.992 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.67 -159.59 14.4 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.655 -0.783 . . . . 62.11 112.49 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.87 155.71 17.98 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.788 0.327 . . . . 63.25 111.115 -179.86 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 132' ' ' ALA . . . . . 0.933 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -112.08 165.19 12.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.209 -0.45 . . . . 51.34 111.128 179.824 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -65.89 -62.61 1.4 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.23 -0.441 . . . . 75.41 110.888 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 53.6 mt -86.59 132.25 32.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.21 -0.45 . . . . 70.51 111.142 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 135' ' ' MET . . . . . 0.485 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 18.4 mmm -110.64 123.1 49.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.214 -0.448 . . . . 72.43 110.892 179.846 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.44 ' O ' HG23 ' A' ' 93' ' ' ILE . 0.5 OUTLIER -106.54 92.87 2.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.256 -0.429 . . . . 70.04 111.133 179.983 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 137' ' ' GLY . . . . . 0.453 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -135.56 162.58 24.91 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.783 -0.722 . . . . 63.34 112.491 179.911 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -105.25 142.53 34.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.856 0.36 . . . . 74.01 110.918 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.486 ' HB1' ' HB3' ' A' ' 143' ' ' HIS . . . 179.74 168.02 1.18 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.199 -0.455 . . . . 71.21 111.107 179.891 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 38.3 mtm180 -103.29 173.43 6.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.226 -0.443 . . . . 62.21 110.899 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -52.8 -19.06 6.31 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.755 -0.736 . . . . 74.24 112.495 -179.931 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -87.89 13.36 10.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.857 0.36 . . . . 75.03 111.127 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 143' ' ' HIS . . . . . 0.486 ' HB3' ' HB1' ' A' ' 139' ' ' ALA . 11.0 p80 -77.05 -22.02 53.59 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.17 -0.468 . . . . 71.11 110.823 -179.924 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 138.18 52.67 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.798 -0.715 . . . . 45.51 112.509 -179.932 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 34.4 p-10 -173.36 156.59 3.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.885 0.374 . . . . 72.14 110.815 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 9.7 m -71.69 173.48 8.07 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.124 -0.489 . . . . 51.25 110.859 -179.781 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 147' ' ' TYR . . . . . 0.434 ' HA ' ' HD2' ' A' ' 148' ' ' PRO . 0.1 OUTLIER 63.1 106.82 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.571 0.7 . . . . 73.4 110.902 -179.887 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 148' ' ' PRO . . . . . 0.434 ' HD2' ' HA ' ' A' ' 147' ' ' TYR . 54.4 Cg_endo -69.71 143.54 51.41 Favored 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.717 2.278 . . . . 74.53 112.353 179.887 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 149' ' ' PHE . . . . . 0.454 ' CE1' ' HB2' ' A' ' 173' ' ' ASP . 0.1 OUTLIER -64.2 -14.7 57.03 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.247 -0.433 . . . . 63.52 110.931 179.943 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 75.6 -4.11 2.44 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.127 -0.488 . . . . 63.11 110.85 179.934 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 66.92 -137.96 34.48 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.711 -0.757 . . . . 71.41 112.515 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.72 141.33 45.08 Favored 'Trans proline' 0 C--O 1.231 0.144 0 C-N-CA 122.699 2.266 . . . . 75.11 112.37 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 103.4 -144.9 16.07 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.778 -0.725 . . . . 70.32 112.456 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -39.01 150.19 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.967 0.413 . . . . 73.25 110.88 -179.834 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 155' ' ' THR . . . . . 0.409 ' CG2' ' HA2' ' A' ' 68' ' ' GLY . 0.2 OUTLIER 75.24 103.71 0.07 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.163 -0.471 . . . . 44.41 111.129 -179.956 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 156' ' ' LEU . . . . . 1.009 HD21 HG21 ' A' ' 186' ' ' ILE . 0.5 OUTLIER -87.08 -54.98 4.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.224 -0.444 . . . . 75.02 110.96 179.911 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 157' ' ' ALA . . . . . 0.557 ' HB1' ' O ' ' A' ' 171' ' ' HIS . . . -162.11 148.47 13.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.471 . . . . 71.42 111.045 179.76 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 32.0 p-80 -112.28 118.74 36.11 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.143 -0.48 . . . . 72.02 110.821 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.673 ' O ' HG21 ' A' ' 69' ' ' VAL . . . -111.16 150.18 29.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 74.42 111.098 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -120.65 172.83 7.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.183 -0.462 . . . . 75.31 110.904 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 161' ' ' ALA . . . . . 0.695 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -104.12 164.26 15.67 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.591 0.71 . . . . 61.04 111.133 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 162' ' ' PRO . . . . . 0.695 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.3 Cg_endo -69.8 88.49 0.54 Allowed 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.68 2.254 . . . . 74.44 112.38 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 163' ' ' GLY . . . . . 0.418 ' HA2' ' HG3' ' A' ' 79' ' ' PRO . . . -124.27 120.44 4.07 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.798 -0.715 . . . . 61.41 112.53 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 2.3 m 73.41 -68.33 0.23 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.823 0.344 . . . . 73.1 111.175 -179.819 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . 176.46 -61.67 0.1 Allowed Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.714 -0.755 . . . . 74.03 112.442 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 166' ' ' LEU . . . . . 0.541 HD23 ' O ' ' A' ' 166' ' ' LEU . 9.7 tt -53.95 -30.99 49.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.854 0.359 . . . . 65.12 110.897 -179.89 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -72.43 -173.87 22.97 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.765 -0.731 . . . . 43.43 112.465 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 73.01 22.93 78.75 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.69 -0.767 . . . . 74.31 112.498 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -100.44 161.6 13.49 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.859 0.362 . . . . 63.41 110.882 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.56 130.76 55.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.204 -0.453 . . . . 74.21 111.024 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 171' ' ' HIS . . . . . 0.557 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 48.3 m170 -127.0 132.74 50.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.181 -0.463 . . . . 72.53 110.862 -180.0 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 38.0 m-85 -116.13 138.86 50.88 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.238 -0.437 . . . . 71.44 110.883 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 173' ' ' ASP . . . . . 0.454 ' HB2' ' CE1' ' A' ' 149' ' ' PHE . 11.1 t0 -64.92 95.19 0.15 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 74.11 110.858 179.983 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 2.9 pp20? -55.64 -18.7 8.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.23 -0.441 . . . . 72.25 110.904 -179.932 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.82 -22.73 42.68 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.177 -0.465 . . . . 73.32 110.884 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 176' ' ' GLU . . . . . 0.438 ' HG3' HD13 ' A' ' 156' ' ' LEU . 0.0 OUTLIER -72.73 -170.99 0.76 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 63.2 110.89 -179.926 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 177' ' ' ARG . . . . . 0.409 ' HG3' ' HA3' ' A' ' 185' ' ' GLY . 0.5 OUTLIER -116.57 114.37 24.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.166 -0.47 . . . . 63.14 110.909 -179.88 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 48.6 m95 -116.77 142.77 46.49 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.173 -0.467 . . . . 72.31 111.014 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 179' ' ' THR . . . . . 0.511 HG21 ' HB3' ' A' ' 182' ' ' SER . 13.1 t -177.66 163.57 1.91 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.279 -0.419 . . . . 74.13 111.183 -179.942 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -125.0 -68.86 0.82 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.22 -0.445 . . . . 45.33 110.913 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -63.6 -13.13 49.79 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.736 -0.745 . . . . 62.41 112.555 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 182' ' ' SER . . . . . 0.511 ' HB3' HG21 ' A' ' 179' ' ' THR . 0.3 OUTLIER -93.48 -24.39 18.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.917 0.389 . . . . 64.5 110.877 -179.8 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 183' ' ' SER . . . . . 0.402 ' C ' ' O ' ' A' ' 182' ' ' SER . 7.4 p 37.97 43.78 0.56 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.091 -0.504 . . . . 64.12 110.854 -179.809 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 1.2 tt -107.51 -33.39 7.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.104 -0.498 . . . . 74.2 110.91 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 185' ' ' GLY . . . . . 0.409 ' HA3' ' HG3' ' A' ' 177' ' ' ARG . . . -113.42 -145.58 9.3 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.736 -0.745 . . . . 73.01 112.485 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 186' ' ' ILE . . . . . 1.009 HG21 HD21 ' A' ' 156' ' ' LEU . 8.2 mm -79.03 99.54 3.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.893 0.377 . . . . 73.22 111.125 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -44.27 123.85 3.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.466 . . . . 71.31 110.873 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 188' ' ' PHE . . . . . 0.702 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.4 t80 -59.83 -38.45 82.06 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.098 -0.501 . . . . 75.45 110.872 -179.92 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 189' ' ' LEU . . . . . 0.496 HD21 ' CG ' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -67.34 -47.61 69.97 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.129 -0.487 . . . . 52.02 110.895 179.984 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 65.6 t80 -67.54 -39.86 84.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.248 -0.433 . . . . 74.22 110.931 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 191' ' ' ALA . . . . . 0.566 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -72.5 -35.21 68.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.091 -0.504 . . . . 50.03 111.121 179.903 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 192' ' ' ALA . . . . . 0.686 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -57.37 -44.69 84.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 52.11 111.079 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 193' ' ' THR . . . . . 0.403 HG21 HG21 ' A' ' 211' ' ' VAL . 13.6 m -58.28 -43.41 88.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.225 -0.443 . . . . 72.43 111.137 -179.911 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 34.1 t60 -72.82 -42.97 63.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.2 -0.455 . . . . 71.44 110.863 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -69.87 -47.72 61.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.221 -0.445 . . . . 71.01 111.106 179.9 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 196' ' ' LEU . . . . . 0.852 HD12 HD12 ' A' ' 113' ' ' LEU . 4.5 mm? -64.62 -33.58 76.28 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.217 -0.447 . . . . 74.51 110.865 -179.942 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -63.58 -26.55 69.85 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.701 -0.761 . . . . 52.23 112.475 179.934 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 198' ' ' HIS . . . . . . . . . . . . . 4.3 m-70 -67.07 -42.66 84.31 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.825 0.345 . . . . 75.21 110.813 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 199' ' ' SER . . . . . 0.416 ' O ' ' HD3' ' A' ' 162' ' ' PRO . 0.1 OUTLIER -61.85 -20.53 63.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.225 -0.443 . . . . 71.13 110.865 -179.755 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 200' ' ' LEU . . . . . 0.423 ' N ' HD23 ' A' ' 200' ' ' LEU . 1.7 mt -86.37 3.2 44.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.091 -0.504 . . . . 64.13 110.872 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 84.1 -9.35 63.79 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.714 -0.755 . . . . 50.41 112.466 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 202' ' ' MET . . . . . . . . . . . . . 42.1 tpp -54.72 153.93 5.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.847 0.356 . . . . 63.21 110.914 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -117.68 177.97 16.79 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.699 -0.762 . . . . 64.44 112.467 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 204' ' ' HIS . . . . . 0.414 ' HA ' ' HB3' ' A' ' 212' ' ' MET . 45.6 m-70 -77.92 149.97 34.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.799 0.333 . . . . 74.32 110.833 -179.955 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 66.2 m -121.86 149.91 42.69 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.18 -0.463 . . . . 53.34 110.835 -179.769 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 79.1 p -87.79 -4.37 58.88 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.126 -0.488 . . . . 72.22 110.849 -179.796 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 207' ' ' ASP . . . . . 0.42 ' HB2' ' HB2' ' A' ' 210' ' ' ALA . 8.4 m-20 -71.62 130.45 87.23 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.614 0.721 . . . . 65.11 110.858 179.974 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.72 -8.28 23.19 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.688 2.258 . . . . 74.53 112.351 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -116.26 11.09 15.0 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.145 -0.48 . . . . 63.52 110.915 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 210' ' ' ALA . . . . . 0.484 ' HB1' ' CE ' ' A' ' 212' ' ' MET . . . -87.18 146.02 26.18 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.132 -0.486 . . . . 62.23 111.088 179.838 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 211' ' ' VAL . . . . . 0.431 HG12 ' HG3' ' A' ' 212' ' ' MET . 0.4 OUTLIER -70.47 -25.07 26.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.196 -0.456 . . . . 62.04 111.104 179.902 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 212' ' ' MET . . . . . 0.492 ' HE2' ' HB2' ' A' ' 230' ' ' ASP . 0.4 OUTLIER -86.35 3.19 44.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.199 -0.455 . . . . 75.22 110.901 179.937 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 213' ' ' TYR . . . . . 0.44 ' HB2' ' O ' ' A' ' 210' ' ' ALA . 2.0 t80 -54.85 110.23 2.05 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-O 121.636 0.731 . . . . 73.43 110.887 -179.88 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.77 -18.55 36.89 Favored 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.705 2.27 . . . . 63.01 112.41 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 215' ' ' THR . . . . . 0.402 ' HB ' ' CE2' ' A' ' 213' ' ' TYR . 0.2 OUTLIER -84.27 53.6 2.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.184 -0.462 . . . . 74.24 111.116 -179.959 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -65.13 123.81 20.5 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.26 -0.427 . . . . 74.14 110.914 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . 168.42 39.42 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.774 -0.727 . . . . 74.22 112.529 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -113.82 -37.63 4.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.865 0.364 . . . . 64.22 110.91 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . 171.24 166.05 29.47 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.701 -0.761 . . . . 72.24 112.472 179.925 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 220' ' ' ASP . . . . . 0.423 ' HA ' ' HD2' ' A' ' 221' ' ' PRO . 2.7 m-20 -103.0 101.41 21.24 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.552 0.692 . . . . 41.43 110.912 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 221' ' ' PRO . . . . . 0.423 ' HD2' ' HA ' ' A' ' 220' ' ' ASP . 53.7 Cg_endo -69.78 115.44 4.1 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.633 2.222 . . . . 73.42 112.369 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -71.46 -18.25 62.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.203 -0.453 . . . . 74.21 110.92 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 -116.14 -36.2 4.15 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.219 -0.446 . . . . 60.33 110.887 -179.944 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER 66.03 143.21 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.143 -0.48 . . . . 65.01 110.841 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.37 147.89 35.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.11 -0.495 . . . . 64.24 110.917 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 226' ' ' LEU . . . . . 0.734 HD13 ' HG2' ' A' ' 119' ' ' GLU . 10.1 mt -75.45 148.92 38.68 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.203 -0.453 . . . . 53.44 110.924 179.973 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 227' ' ' SER . . . . . 0.427 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 2.1 t -87.2 155.3 20.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.241 -0.436 . . . . 74.21 110.84 -179.926 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -64.11 -66.25 0.57 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.099 -0.5 . . . . 74.54 110.957 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -55.69 -25.62 40.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.181 -0.463 . . . . 72.22 110.904 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 230' ' ' ASP . . . . . 0.492 ' HB2' ' HE2' ' A' ' 212' ' ' MET . 1.3 t70 -68.84 -48.45 63.45 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.169 -0.469 . . . . 74.23 110.855 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 231' ' ' ILE . . . . . 0.634 HG23 ' HB3' ' A' ' 119' ' ' GLU . 12.0 mt -68.21 -42.26 84.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.231 -0.44 . . . . 73.41 111.067 180.0 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 15.2 pttm -65.9 -32.14 73.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.199 -0.455 . . . . 65.42 110.929 179.879 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -62.62 -46.63 93.34 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.756 -0.735 . . . . 63.43 112.472 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 12.2 tt -72.93 -30.54 32.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.779 0.323 . . . . 71.54 111.101 -179.95 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -70.96 -24.71 62.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.174 -0.466 . . . . 70.33 110.879 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 236' ' ' LYS . . . . . 0.428 ' HE2' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.1 -26.82 60.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.218 -0.446 . . . . 51.21 110.903 179.969 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 237' ' ' LEU . . . . . 0.764 HD13 ' HD2' ' A' ' 83' ' ' LYS . 10.3 tt -97.25 -24.54 15.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.224 -0.443 . . . . 75.41 110.937 179.878 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 238' ' ' TYR . . . . . 0.625 ' CZ ' HD11 ' A' ' 122' ' ' LEU . 6.3 m-85 -92.36 -35.07 13.92 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.228 -0.442 . . . . 51.24 110.913 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -129.56 -120.08 2.21 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.791 -0.718 . . . . 32.22 112.524 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.41 135.1 33.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.777 0.322 . . . . 75.42 110.883 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.43 176.7 5.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.268 -0.424 . . . . 73.34 110.867 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 1.9 t -161.46 -53.23 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.194 -0.457 . . . . 62.42 110.835 -179.796 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -177.94 110.91 0.07 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.122 -0.49 . . . . 72.13 110.906 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 7.6 p -165.93 175.86 8.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.194 -0.457 . . . . 62.23 110.912 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.6 -169.9 2.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.097 -0.501 . . . . 70.43 110.895 -179.952 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.09 -170.17 3.56 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.206 -0.452 . . . . 72.11 110.843 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 6.8 mmmt . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.186 -0.461 . . . . 74.13 110.864 179.842 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 302' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' -2' ' ' LEU . . . . . 0.481 ' N ' ' HD2' ' A' ' -1' ' ' PRO . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.123 0 CA-C-O 121.551 0.691 . . . . 73.02 110.915 . . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' -1' ' ' PRO . . . . . 0.481 ' HD2' ' N ' ' A' ' -2' ' ' LEU . 52.9 Cg_endo -69.85 -172.1 0.55 Allowed 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.711 2.274 . . . . 71.15 112.308 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -138.89 160.57 62.37 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.572 0.701 . . . . 62.13 110.935 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.67 130.17 18.98 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.727 2.285 . . . . 64.14 112.409 179.854 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -147.6 -42.15 0.17 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.298 -0.41 . . . . 60.51 110.851 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -61.07 -18.58 58.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.259 -0.428 . . . . 74.01 110.869 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.512 ' HB1' ' HE2' ' A' ' 7' ' ' MET . . . -56.35 -33.95 66.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.181 -0.463 . . . . 71.4 111.115 179.916 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -55.82 -33.93 60.58 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.756 -0.735 . . . . 60.51 112.539 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -108.94 20.31 29.12 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.818 -0.706 . . . . 54.22 112.48 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' MET . . . . . 0.512 ' HE2' ' HB1' ' A' ' 4' ' ' ALA . 15.9 ptp -59.75 164.1 3.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.823 0.344 . . . . 72.23 110.876 -179.998 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -73.01 154.64 40.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.282 -0.417 . . . . 73.24 110.856 -179.801 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -54.4 -31.94 56.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.126 -0.488 . . . . 50.12 110.879 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.55 -42.7 86.74 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.147 -0.479 . . . . 72.33 110.931 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 45.1 mm-40 -62.67 -45.26 93.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.204 -0.453 . . . . 72.14 110.907 179.898 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 11.6 t-105 -73.15 -31.16 64.09 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.195 -0.457 . . . . 71.22 110.954 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -73.28 -35.37 66.15 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.217 -0.447 . . . . 72.51 110.861 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -62.96 -36.92 85.06 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.229 -0.441 . . . . 61.24 110.92 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.632 ' CB ' HD21 ' A' ' 54' ' ' LEU . . . -59.16 -41.2 87.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 54.34 111.078 179.889 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 43.1 tp60 -72.92 -42.99 62.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.245 -0.434 . . . . 73.12 110.911 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -65.86 -31.82 72.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.219 -0.446 . . . . 72.4 110.847 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -70.33 -35.86 73.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.172 -0.467 . . . . 75.11 110.85 -179.725 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.682 HD13 ' HG2' ' A' ' 38' ' ' LYS . 1.9 mt -71.06 -21.03 62.3 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.157 -0.474 . . . . 72.51 110.952 179.925 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.0 ptmt -75.35 -29.88 60.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.128 -0.487 . . . . 74.41 110.856 179.867 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.7 ptp180 -86.2 -27.22 24.65 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.259 -0.428 . . . . 74.05 110.839 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -59.62 -21.24 60.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.207 -0.451 . . . . 74.31 110.885 -179.888 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.439 ' CE2' HD22 ' A' ' 19' ' ' LEU . 5.8 m-85 -120.94 46.2 2.08 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.164 -0.471 . . . . 72.55 110.939 -179.89 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.4 mt 64.23 -168.62 0.2 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.153 -0.476 . . . . 75.43 110.903 179.92 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -90.79 89.72 7.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 71.41 110.963 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -117.16 112.63 21.11 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.115 -0.493 . . . . 74.25 110.807 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -85.12 -6.41 59.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.158 -0.474 . . . . 62.15 110.853 -179.812 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -67.25 -11.67 58.09 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.187 -0.46 . . . . 74.51 110.882 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.572 HG21 ' HD2' ' A' ' 38' ' ' LYS . 2.4 m -85.66 8.6 18.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.15 -0.477 . . . . 70.44 111.188 -179.931 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 10.9 ttpt -51.46 170.23 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.187 -0.46 . . . . 73.33 110.939 179.881 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 6.6 m120 66.3 149.15 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.238 -0.437 . . . . 64.43 110.899 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.11 -22.77 58.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.214 -0.448 . . . . 70.21 111.054 179.914 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -57.83 -22.1 45.85 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.237 -0.438 . . . . 35.31 110.878 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 68.8 m -86.73 -19.47 29.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.213 -0.449 . . . . 74.02 110.857 -179.899 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.437 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 8.6 tt -57.52 -45.23 85.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.105 -0.498 . . . . 72.52 110.885 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.44 -51.25 70.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.204 -0.453 . . . . 73.13 110.894 179.918 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -66.04 -36.6 83.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.171 -0.468 . . . . 63.32 111.126 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.682 ' HG2' HD13 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -65.59 -49.08 70.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.447 . . . . 72.32 110.912 179.934 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.439 ' CD2' HD12 ' A' ' 19' ' ' LEU . 4.6 mt -63.19 -35.38 80.11 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.156 -0.475 . . . . 72.11 110.914 179.924 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.8 tttt -68.48 -45.73 71.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.249 -0.432 . . . . 62.43 110.876 179.83 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.547 ' HG3' ' N ' ' A' ' 42' ' ' MET . 0.0 OUTLIER -59.93 -31.87 70.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.193 -0.458 . . . . 75.11 110.946 179.949 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.726 ' CE ' HD11 ' A' ' 61' ' ' ILE . 38.2 ttp -68.5 -34.09 75.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.142 -0.481 . . . . 63.43 110.901 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.458 ' OE1' HD11 ' A' ' 48' ' ' LEU . 1.2 mm-40 -60.65 -39.44 88.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.209 -0.45 . . . . 74.45 110.92 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.1 mmpt? -68.37 -28.36 67.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.47 . . . . 71.43 110.874 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 28.1 t80 -70.28 -45.01 67.2 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.18 -0.464 . . . . 73.32 110.86 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.588 ' CZ ' HD12 ' A' ' 61' ' ' ILE . 17.2 m-85 -81.98 -35.12 29.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.174 -0.466 . . . . 70.43 110.913 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 102.73 -7.13 52.9 Favored Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.75 -0.738 . . . . 64.34 112.466 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.474 HD23 ' CB ' ' A' ' 46' ' ' PHE . 0.8 OUTLIER -59.82 138.78 90.33 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.565 0.697 . . . . 64.11 110.968 -179.975 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.519 ' O ' HG23 ' A' ' 51' ' ' THR . 53.9 Cg_endo -69.73 -53.01 0.29 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.651 2.234 . . . . 74.5 112.374 179.886 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.664 HD12 HG23 ' A' ' 58' ' ' VAL . 0.9 OUTLIER -51.32 108.22 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.215 -0.448 . . . . 71.22 111.126 179.881 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.519 HG23 ' O ' ' A' ' 49' ' ' PRO . 41.4 p -109.0 164.37 12.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.178 -0.464 . . . . 73.25 111.118 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 59.56 17.65 41.62 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.723 -0.751 . . . . 64.24 112.475 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -114.57 161.05 18.56 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.857 0.361 . . . . 75.23 110.837 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.632 HD21 ' CB ' ' A' ' 15' ' ' ALA . 26.8 tp -168.56 84.99 0.17 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.206 -0.452 . . . . 73.4 110.903 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.418 ' HA ' HG13 ' A' ' 59' ' ' ILE . 3.4 p30 175.55 -29.24 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.148 -0.478 . . . . 44.35 110.91 179.914 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 28.5 t -90.84 -100.52 0.1 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.156 -0.474 . . . . 75.25 110.902 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.587 ' O ' HG23 ' A' ' 61' ' ' ILE . 10.7 tpt180 -85.05 -28.89 25.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.155 -0.475 . . . . 61.22 110.884 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.664 HG23 HD12 ' A' ' 50' ' ' ILE . 66.6 t -64.98 -41.56 92.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.188 -0.46 . . . . 70.12 111.103 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.425 HD11 ' HB2' ' A' ' 15' ' ' ALA . 1.0 OUTLIER -74.59 -31.45 27.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.206 -0.452 . . . . 74.43 111.164 179.895 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.03 -33.09 70.34 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.121 -0.49 . . . . 73.45 110.91 179.925 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.726 HD11 ' CE ' ' A' ' 42' ' ' MET . 0.4 OUTLIER -76.45 -29.56 18.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.125 -0.489 . . . . 74.52 111.093 -179.975 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.417 ' HE3' ' HB1' ' A' ' 15' ' ' ALA . 5.2 mmt -64.41 -37.35 87.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.144 -0.48 . . . . 74.01 110.88 179.891 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -86.58 -23.29 25.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.26 -0.427 . . . . 42.22 110.918 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -85.08 124.97 71.58 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.588 0.709 . . . . 65.34 110.842 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 160.49 49.51 Favored 'Trans proline' 0 C--O 1.233 0.254 0 C-N-CA 122.683 2.255 . . . . 72.11 112.406 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -155.53 -77.46 0.1 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.31 -0.405 . . . . 71.51 110.914 -179.957 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -145.18 155.18 43.13 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.119 -0.491 . . . . 55.3 110.843 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.561 ' HA2' HG23 ' A' ' 155' ' ' THR . . . -97.53 11.81 64.86 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.727 -0.749 . . . . 64.23 112.534 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.652 HG21 ' CD2' ' A' ' 198' ' ' HIS . 0.9 OUTLIER -92.37 136.47 25.51 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.703 0.763 . . . . 74.23 111.139 -179.958 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.507 ' HD2' HG12 ' A' ' 69' ' ' VAL . 54.1 Cg_endo -69.75 155.1 66.87 Favored 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.691 2.26 . . . . 63.44 112.338 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -92.66 15.49 14.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.224 -0.444 . . . . 74.45 110.88 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -122.76 129.06 75.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.183 -0.462 . . . . 53.43 111.108 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -131.1 170.66 14.23 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.194 -0.457 . . . . 73.13 111.119 179.832 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -136.74 142.46 43.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.215 -0.448 . . . . 73.31 110.868 -179.839 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 39.3 p90 -49.23 121.34 4.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.181 -0.463 . . . . 70.41 110.874 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.56 179.31 0.17 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.151 -0.477 . . . . 74.2 110.832 -179.899 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -142.9 -53.79 0.4 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.127 -0.488 . . . . 70.34 110.938 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' PHE . . . . . 0.475 ' CB ' ' CD ' ' A' ' 79' ' ' PRO . 1.7 m-85 -70.87 -61.53 2.36 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.671 0.748 . . . . 71.24 110.818 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.475 ' CD ' ' CB ' ' A' ' 78' ' ' PHE . 53.5 Cg_endo -69.8 145.53 57.19 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.671 2.247 . . . . 73.34 112.336 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 33.3 m120 -88.38 129.38 35.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.223 -0.444 . . . . 74.43 110.914 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 64.2 153.7 0.12 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.647 0.737 . . . . 70.4 110.892 -179.845 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 -50.46 0.46 Allowed 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.75 2.3 . . . . 71.11 112.378 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.748 ' HD2' HD22 ' A' ' 237' ' ' LEU . 2.6 mttm -84.08 161.74 20.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.157 -0.474 . . . . 64.45 110.895 179.885 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' TRP . . . . . 0.751 ' CE3' HG21 ' A' ' 89' ' ' VAL . 40.6 m0 -49.63 123.48 7.87 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.158 -0.474 . . . . 73.31 110.983 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 9.9 t -115.19 -19.43 10.82 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.241 -0.436 . . . . 65.3 111.128 -179.888 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -53.46 160.98 1.08 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.216 -0.447 . . . . 70.34 110.832 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 2.8 ptmt -74.03 -30.61 62.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.064 -0.516 . . . . 71.12 110.892 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -152.72 144.54 15.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.235 -0.439 . . . . 74.14 111.105 179.938 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.751 HG21 ' CE3' ' A' ' 84' ' ' TRP . 12.2 t -130.77 140.95 47.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.22 -0.445 . . . . 72.25 111.101 179.852 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.764 HG22 ' HB3' ' A' ' 125' ' ' ARG . 11.0 p -117.18 167.94 10.74 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.088 -0.505 . . . . 71.01 111.128 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.435 ' HB3' ' HB ' ' A' ' 134' ' ' ILE . 4.9 p90 -150.35 146.55 26.8 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.198 -0.456 . . . . 70.51 110.961 -179.856 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 4.5 ttt-85 -146.29 136.24 23.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.165 -0.471 . . . . 71.25 110.854 -179.897 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.447 HD11 ' HA ' ' A' ' 106' ' ' ASP . 3.4 mp -74.76 135.54 27.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.169 -0.469 . . . . 72.4 111.195 179.903 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.405 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 19.3 t -89.15 -40.7 13.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.2 -0.454 . . . . 60.2 111.112 179.914 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 5.6 t -144.56 163.4 34.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.208 -0.451 . . . . 64.24 110.857 -179.852 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 11.2 p90 -110.58 152.47 26.39 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.138 -0.483 . . . . 72.25 110.921 -179.886 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.474 ' OG1' HG21 ' A' ' 105' ' ' VAL . 0.2 OUTLIER -82.68 140.99 32.8 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.117 -0.492 . . . . 64.11 111.173 -179.989 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.92 -7.8 52.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.197 -0.456 . . . . 72.14 110.923 179.987 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -96.42 -26.1 15.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.251 -0.431 . . . . 74.13 110.889 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.508 HD11 ' HA ' ' A' ' 179' ' ' THR . 0.9 OUTLIER -133.54 153.6 80.38 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.591 0.71 . . . . 72.52 111.006 -179.956 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 101' ' ' PRO . . . . . 0.569 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.9 Cg_endo -69.71 150.89 69.13 Favored 'Trans proline' 0 C--O 1.231 0.159 0 C-N-CA 122.703 2.269 . . . . 73.11 112.365 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 15.9 t-160 -52.74 -27.38 17.46 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.221 -0.445 . . . . 74.11 110.866 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.569 HG22 ' HB2' ' A' ' 101' ' ' PRO . 0.0 OUTLIER -75.72 -39.43 39.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.18 -0.463 . . . . 74.02 111.109 -179.956 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 104' ' ' THR . . . . . 0.681 ' O ' HD22 ' A' ' 108' ' ' LEU . 3.1 m -69.33 -39.13 78.37 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.114 -0.493 . . . . 52.11 111.154 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.689 ' O ' HG13 ' A' ' 109' ' ' VAL . 92.0 t -72.61 -44.83 60.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.224 -0.444 . . . . 71.51 111.119 179.904 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.635 ' O ' HG22 ' A' ' 109' ' ' VAL . 3.9 t0 -66.25 -41.91 89.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.215 -0.448 . . . . 63.44 110.841 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 6.6 ptm180 -69.9 -33.8 72.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 75.02 110.829 -179.839 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.681 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -60.73 -48.95 79.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.196 -0.456 . . . . 71.04 110.882 -179.96 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.689 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.3 m -55.61 -41.96 66.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.181 -0.463 . . . . 72.31 111.112 179.893 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.469 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 42.7 t -69.97 -34.1 72.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.142 -0.481 . . . . 72.14 110.874 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.453 ' CG ' HD21 ' A' ' 189' ' ' LEU . 0.4 OUTLIER -62.46 -33.33 74.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.111 -0.495 . . . . 74.35 110.882 179.964 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -94.02 -40.97 9.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.288 -0.415 . . . . 74.32 111.12 179.792 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.75 ' CD1' HD12 ' A' ' 196' ' ' LEU . 0.5 OUTLIER -65.47 -32.91 74.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.179 -0.464 . . . . 72.0 110.969 179.937 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -67.9 -38.06 82.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.226 -0.443 . . . . 72.34 110.946 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' MET . . . . . 0.657 ' O ' HD11 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -62.41 -34.62 77.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.083 -0.508 . . . . 54.12 110.881 179.871 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 116' ' ' TRP . . . . . 0.41 ' CZ3' ' SD ' ' A' ' 202' ' ' MET . 8.4 m95 -65.98 -52.29 50.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.198 -0.455 . . . . 75.23 110.929 -179.968 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -63.94 -37.22 94.31 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.728 -0.749 . . . . 73.32 112.453 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.41 -16.31 45.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.758 0.313 . . . . 72.42 110.888 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.65 ' HG3' HG21 ' A' ' 231' ' ' ILE . 0.2 OUTLIER -101.2 12.13 38.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.278 -0.419 . . . . 75.24 110.938 179.938 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.879 HD12 HD12 ' A' ' 122' ' ' LEU . 5.1 pt -149.7 149.36 28.07 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.59 0.709 . . . . 71.34 111.113 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.72 25.71 0.17 Allowed 'Trans proline' 0 C--O 1.231 0.166 0 C-N-CA 122.668 2.245 . . . . 72.21 112.354 179.92 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.879 HD12 HD12 ' A' ' 120' ' ' ILE . 9.9 mt -80.43 -157.53 0.15 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.193 -0.458 . . . . 73.22 110.908 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.416 ' H ' ' HB3' ' A' ' 122' ' ' LEU . 20.8 t-80 -163.78 133.59 4.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 74.12 110.855 179.868 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 23.4 m-30 -119.59 142.58 48.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.242 -0.436 . . . . 75.54 110.899 -179.902 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.764 ' HB3' HG22 ' A' ' 90' ' ' THR . 0.1 OUTLIER -118.85 141.92 48.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.157 -0.474 . . . . 75.14 110.916 -179.991 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 126' ' ' LYS . . . . . 0.506 ' HE3' HG13 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -80.42 149.48 30.13 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.133 -0.485 . . . . 72.22 110.896 179.996 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 127' ' ' VAL . . . . . 1.024 HG11 ' HB2' ' A' ' 132' ' ' ALA . 27.4 m -103.21 126.5 57.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.267 -0.424 . . . . 50.13 111.086 179.933 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.587 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -143.55 -11.79 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.237 -0.438 . . . . 74.43 111.18 179.872 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 129' ' ' TRP . . . . . 0.587 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -153.78 109.22 3.2 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.178 -0.464 . . . . 71.25 110.931 179.967 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.59 -161.2 13.69 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.745 -0.74 . . . . 62.11 112.445 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -101.82 155.97 17.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.767 0.317 . . . . 63.25 111.117 -179.818 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 132' ' ' ALA . . . . . 1.024 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -111.93 165.3 12.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 51.34 111.132 179.84 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -75.9 -62.02 1.73 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.202 -0.454 . . . . 75.41 110.869 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 134' ' ' ILE . . . . . 0.635 HD12 ' N ' ' A' ' 134' ' ' ILE . 1.3 mp -82.57 107.5 14.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.254 -0.43 . . . . 70.51 111.117 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 135' ' ' MET . . . . . 0.405 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 11.1 mmm -92.94 131.78 37.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.221 -0.445 . . . . 72.43 110.876 179.797 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.589 ' CD1' HG22 ' A' ' 134' ' ' ILE . 0.3 OUTLIER -113.34 95.33 3.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.251 -0.432 . . . . 70.04 111.141 179.956 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -136.1 165.51 24.88 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.796 -0.716 . . . . 63.34 112.499 179.919 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 138' ' ' PHE . . . . . 0.543 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 43.5 m-85 -106.42 149.68 26.79 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.859 0.361 . . . . 74.01 110.861 -179.816 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.543 ' HB2' ' O ' ' A' ' 138' ' ' PHE . . . 170.49 166.42 0.07 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.138 -0.483 . . . . 71.21 111.113 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -104.6 173.53 6.26 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.213 -0.449 . . . . 62.21 110.87 -179.916 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -55.13 -17.45 10.54 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.797 -0.716 . . . . 74.24 112.454 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -87.33 12.97 10.68 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.795 0.331 . . . . 75.03 111.086 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 6.1 p80 -81.44 -4.38 55.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.235 -0.438 . . . . 71.11 110.788 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 124.68 7.31 6.23 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.778 -0.725 . . . . 45.51 112.521 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 29.1 m-20 -111.19 163.64 13.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.856 0.36 . . . . 72.14 110.854 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -87.44 176.89 7.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.173 -0.467 . . . . 51.25 110.854 -179.74 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 66.46 127.98 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.687 0.755 . . . . 73.4 110.933 -179.921 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.87 145.42 56.45 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.677 2.251 . . . . 74.53 112.332 179.967 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 149' ' ' PHE . . . . . 0.403 ' CE1' ' HB2' ' A' ' 173' ' ' ASP . 0.1 OUTLIER -90.87 -31.61 16.37 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.186 -0.461 . . . . 63.52 110.894 -179.985 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 74.39 -1.67 3.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.145 -0.48 . . . . 63.11 110.855 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 151' ' ' GLY . . . . . 0.638 ' O ' 'CA ' ' A' ' 302' ' ' ' CA' . . . 50.04 -108.52 0.5 Allowed Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.721 -0.752 . . . . 71.41 112.48 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -69.71 139.41 40.33 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.707 2.271 . . . . 75.11 112.401 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 103.29 -153.76 18.06 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.712 -0.756 . . . . 70.32 112.484 179.987 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 154' ' ' ASN . . . . . 0.412 ' O ' ' CB ' ' A' ' 155' ' ' THR . 4.4 p30 -42.77 155.06 0.06 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.904 0.383 . . . . 73.25 110.872 -179.883 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 155' ' ' THR . . . . . 0.561 HG23 ' HA2' ' A' ' 68' ' ' GLY . 0.2 OUTLIER 78.44 114.01 0.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.152 -0.476 . . . . 44.41 111.182 -179.95 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 156' ' ' LEU . . . . . 1.05 HD21 HG21 ' A' ' 186' ' ' ILE . 1.1 tp -101.49 -51.79 3.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.22 -0.446 . . . . 75.02 110.94 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 157' ' ' ALA . . . . . 0.533 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -159.65 148.46 17.74 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.11 -0.495 . . . . 71.42 111.113 179.812 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 37.0 p-80 -110.32 123.2 49.39 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.215 -0.448 . . . . 72.02 110.868 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.55 ' H ' HG22 ' A' ' 69' ' ' VAL . . . -110.36 160.17 16.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.263 -0.426 . . . . 74.42 111.115 179.944 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 16.6 m-30 -118.91 163.32 17.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.205 -0.452 . . . . 75.31 110.852 -179.894 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 161' ' ' ALA . . . . . 0.725 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -88.09 165.02 31.22 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.543 0.687 . . . . 61.04 111.127 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 162' ' ' PRO . . . . . 0.725 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.6 Cg_endo -69.76 71.61 1.51 Allowed 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.629 2.219 . . . . 74.44 112.377 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -127.91 108.82 0.97 Allowed Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.77 -0.729 . . . . 61.41 112.491 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 1.4 p 59.23 173.74 0.07 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.79 0.329 . . . . 73.1 111.104 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -55.59 -33.74 59.56 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.667 -0.778 . . . . 74.03 112.514 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -71.28 -18.03 62.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.83 0.348 . . . . 65.12 110.89 -179.929 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -88.93 167.29 34.56 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.762 -0.732 . . . . 43.43 112.559 179.854 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 168' ' ' GLY . . . . . 0.445 ' O ' HG13 ' A' ' 134' ' ' ILE . . . 72.95 15.83 78.36 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.772 -0.728 . . . . 74.31 112.468 -179.893 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -85.76 141.36 29.74 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.823 0.344 . . . . 63.41 110.876 -179.957 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -111.8 130.14 55.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.24 -0.436 . . . . 74.21 111.126 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 171' ' ' HIS . . . . . 0.521 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 49.6 m170 -131.24 132.49 44.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.215 -0.448 . . . . 72.53 110.927 -179.966 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 31.8 m-85 -111.52 138.02 48.59 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.208 -0.451 . . . . 71.44 110.859 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 173' ' ' ASP . . . . . 0.403 ' HB2' ' CE1' ' A' ' 149' ' ' PHE . 65.7 t0 -65.28 96.02 0.21 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.193 -0.458 . . . . 74.11 110.82 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.66 -16.16 9.83 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.234 -0.439 . . . . 72.25 110.911 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -79.01 -16.35 57.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.122 -0.49 . . . . 73.32 110.831 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 23.7 mm-40 -84.61 -171.48 3.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.22 -0.445 . . . . 63.2 110.956 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 177' ' ' ARG . . . . . 0.43 ' HG3' ' HA3' ' A' ' 185' ' ' GLY . 0.0 OUTLIER -115.91 118.66 33.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.156 -0.474 . . . . 63.14 110.854 -179.941 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 178' ' ' TRP . . . . . 0.401 ' CE3' ' HB ' ' A' ' 186' ' ' ILE . 45.8 m95 -117.01 144.3 44.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.145 -0.479 . . . . 72.31 110.909 -179.95 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 179' ' ' THR . . . . . 0.508 ' HA ' HD11 ' A' ' 100' ' ' LEU . 12.3 t -178.04 163.65 1.76 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.211 -0.449 . . . . 74.13 111.132 -179.936 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -125.25 -69.7 0.78 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.274 -0.421 . . . . 45.33 110.885 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -63.2 -13.24 48.27 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.788 -0.72 . . . . 62.41 112.478 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 182' ' ' SER . . . . . 0.491 ' HB3' HG21 ' A' ' 179' ' ' THR . 0.3 OUTLIER -93.14 -24.31 18.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.939 0.399 . . . . 64.5 110.85 -179.788 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 86.6 p 37.93 43.74 0.55 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 64.12 110.888 -179.807 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -107.84 -33.54 7.21 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.071 -0.513 . . . . 74.2 110.919 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 185' ' ' GLY . . . . . 0.43 ' HA3' ' HG3' ' A' ' 177' ' ' ARG . . . -112.67 -145.11 9.44 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.711 -0.756 . . . . 73.01 112.525 179.872 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 186' ' ' ILE . . . . . 1.05 HG21 HD21 ' A' ' 156' ' ' LEU . 11.5 mm -78.87 97.8 2.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.9 0.381 . . . . 73.22 111.121 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 22.1 m-80 -44.55 118.17 1.49 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.216 -0.447 . . . . 71.31 110.884 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 188' ' ' PHE . . . . . 0.632 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.4 t80 -53.96 -36.37 62.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.145 -0.479 . . . . 75.45 110.877 179.998 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 189' ' ' LEU . . . . . 0.453 HD21 ' CG ' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -67.18 -47.16 71.76 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.164 -0.471 . . . . 52.02 110.898 -179.932 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 6.2 t80 -69.24 -38.93 78.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.186 -0.461 . . . . 74.22 110.92 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 191' ' ' ALA . . . . . 0.615 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -72.01 -35.83 69.53 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.125 -0.489 . . . . 50.03 111.134 179.837 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 192' ' ' ALA . . . . . 0.615 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -56.98 -45.0 83.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.195 -0.457 . . . . 52.11 111.078 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 193' ' ' THR . . . . . 0.594 HG21 ' HE1' ' A' ' 224' ' ' PHE . 0.3 OUTLIER -58.52 -41.25 85.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.217 -0.447 . . . . 72.43 111.153 -179.919 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 13.7 t-160 -72.77 -45.41 58.72 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.18 -0.464 . . . . 71.44 110.877 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -69.42 -47.41 64.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.206 -0.452 . . . . 71.01 111.095 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 196' ' ' LEU . . . . . 0.75 HD12 ' CD1' ' A' ' 113' ' ' LEU . 4.0 mm? -66.26 -43.18 87.19 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.244 -0.434 . . . . 74.51 110.903 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -60.67 -24.29 61.94 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.79 -0.719 . . . . 52.23 112.472 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 198' ' ' HIS . . . . . 0.652 ' CD2' HG21 ' A' ' 69' ' ' VAL . 5.7 m-70 -68.08 -42.69 80.01 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.807 0.337 . . . . 75.21 110.928 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 199' ' ' SER . . . . . 0.451 ' O ' ' HD3' ' A' ' 162' ' ' PRO . 41.4 t -62.15 -23.3 66.5 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.182 -0.463 . . . . 71.13 110.91 -179.854 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 1.6 mt -85.23 2.58 43.25 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.075 -0.511 . . . . 64.13 110.965 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 84.91 -9.37 66.14 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.817 -0.706 . . . . 50.41 112.434 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 202' ' ' MET . . . . . 0.417 ' CE ' ' HB ' ' A' ' 234' ' ' ILE . 0.0 OUTLIER -57.55 130.47 46.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.782 0.325 . . . . 63.21 110.915 179.962 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -101.03 175.12 25.92 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.777 -0.725 . . . . 64.44 112.451 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 17.3 m-70 -68.09 163.47 22.4 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.766 0.317 . . . . 74.32 110.909 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -127.06 156.36 41.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.228 -0.442 . . . . 53.34 110.899 -179.788 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 5.6 p -87.65 -4.28 58.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.208 -0.451 . . . . 72.22 110.817 -179.75 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 207' ' ' ASP . . . . . 0.469 ' HB2' ' HB2' ' A' ' 210' ' ' ALA . 24.4 m-20 -71.29 133.62 85.3 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-O 121.635 0.731 . . . . 65.11 110.811 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 -6.0 17.55 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.682 2.255 . . . . 74.53 112.297 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 -127.64 26.49 5.91 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.252 -0.431 . . . . 63.52 110.841 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 210' ' ' ALA . . . . . 0.469 ' HB2' ' HB2' ' A' ' 207' ' ' ASP . . . -87.4 145.65 26.21 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.234 -0.439 . . . . 62.23 111.071 179.821 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 211' ' ' VAL . . . . . 0.49 HG21 HG21 ' A' ' 193' ' ' THR . 0.4 OUTLIER -67.49 -27.35 38.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.207 -0.451 . . . . 62.04 111.128 179.959 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 35.6 mmm -93.83 6.13 49.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.454 . . . . 75.22 110.866 179.881 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 213' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -55.91 111.87 3.66 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.666 0.746 . . . . 73.43 110.955 -179.877 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.79 -17.79 37.24 Favored 'Trans proline' 0 C--N 1.341 0.135 0 C-N-CA 122.688 2.259 . . . . 63.01 112.32 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.13 60.48 5.93 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.232 -0.44 . . . . 74.24 111.1 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -46.6 122.67 4.34 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.191 -0.459 . . . . 74.14 110.914 -179.923 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -94.15 175.47 34.97 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.782 -0.723 . . . . 74.22 112.468 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -68.4 -74.47 0.12 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.841 0.353 . . . . 64.22 110.903 -179.956 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . -62.07 105.45 0.95 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.784 -0.722 . . . . 72.24 112.439 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 220' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -91.36 153.6 44.4 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.678 0.751 . . . . 41.43 110.857 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.7 139.17 39.76 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.622 2.214 . . . . 73.42 112.346 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -81.5 -22.74 37.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.25 -0.432 . . . . 74.21 110.91 179.992 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 25.1 t30 -114.32 -40.14 3.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.215 -0.448 . . . . 60.33 110.874 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 224' ' ' PHE . . . . . 0.594 ' HE1' HG21 ' A' ' 193' ' ' THR . 0.0 OUTLIER 66.96 134.62 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.166 -0.47 . . . . 65.01 110.864 179.996 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.86 158.59 43.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.087 -0.506 . . . . 64.24 110.963 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 226' ' ' LEU . . . . . 0.7 ' HB3' HD11 ' A' ' 231' ' ' ILE . 50.4 mt -69.74 148.92 48.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.231 -0.44 . . . . 53.44 110.908 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 227' ' ' SER . . . . . 0.492 ' O ' HD12 ' A' ' 231' ' ' ILE . 0.0 OUTLIER -87.17 148.49 25.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.173 -0.467 . . . . 74.21 110.886 -179.96 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.7 -64.07 0.96 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.158 -0.474 . . . . 74.54 110.919 -179.953 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -55.66 -27.68 51.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.171 -0.468 . . . . 72.22 110.852 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -70.05 -49.36 51.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.157 -0.474 . . . . 74.23 110.857 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 231' ' ' ILE . . . . . 0.7 HD11 ' HB3' ' A' ' 226' ' ' LEU . 8.3 mt -69.39 -44.27 80.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.22 -0.446 . . . . 73.41 111.135 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 1.2 ptmt -56.41 -32.58 64.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.139 -0.482 . . . . 65.42 110.901 179.812 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -64.95 -50.54 57.5 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.791 -0.719 . . . . 63.43 112.464 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 234' ' ' ILE . . . . . 0.497 HD11 ' CE1' ' A' ' 238' ' ' TYR . 8.0 tt -73.82 -31.11 30.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.817 0.342 . . . . 71.54 111.16 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -61.67 -23.7 66.25 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.158 -0.474 . . . . 70.33 110.889 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 236' ' ' LYS . . . . . 0.433 ' HE2' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.39 -24.61 59.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.252 -0.431 . . . . 51.21 110.884 179.947 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 237' ' ' LEU . . . . . 0.748 HD22 ' HD2' ' A' ' 83' ' ' LYS . 9.2 tt -93.02 -30.27 15.4 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.252 -0.431 . . . . 75.41 110.918 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 238' ' ' TYR . . . . . 0.497 ' CE1' HD11 ' A' ' 234' ' ' ILE . 46.9 m-85 -92.27 -35.4 13.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.167 -0.47 . . . . 51.24 110.921 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -115.62 -121.36 3.4 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.679 -0.772 . . . . 32.22 112.384 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 4.8 tttm -97.68 131.56 44.12 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.817 0.342 . . . . 75.42 110.919 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 7.6 ptt180 -50.59 162.23 0.26 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.189 -0.46 . . . . 73.34 110.818 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -172.92 -52.43 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 62.42 110.863 -179.831 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -97.0 -170.96 2.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.126 -0.488 . . . . 72.13 110.875 -179.956 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -140.48 -73.21 0.35 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 62.23 110.816 -179.828 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 63.09 175.93 0.15 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.177 -0.465 . . . . 70.43 110.931 -179.885 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 36.6 pttt -131.28 34.0 4.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.217 -0.447 . . . . 72.11 110.951 179.917 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.218 -0.446 . . . . 74.13 110.915 179.901 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 302' ' ' ' CA' . . . . . 0.638 'CA ' ' O ' ' A' ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' -2' ' ' LEU . . . . . . . . . . . . . 4.5 mm? . . . . . 0 C--O 1.232 0.132 0 CA-C-O 121.636 0.731 . . . . 73.02 110.91 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' -1' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.85 -173.27 0.7 Allowed 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.673 2.249 . . . . 71.15 112.319 179.898 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 2.4 mp -115.84 160.61 34.46 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.606 0.717 . . . . 62.13 110.89 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.67 -171.74 0.5 Allowed 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.643 2.229 . . . . 64.14 112.371 179.863 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 71.5 -69.49 0.18 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.228 -0.442 . . . . 60.51 110.918 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -56.01 -32.43 63.98 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.231 -0.44 . . . . 74.01 110.839 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.95 -34.03 67.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.207 -0.452 . . . . 71.4 111.103 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -55.91 -31.62 58.55 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.675 -0.774 . . . . 60.51 112.499 -179.979 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -107.84 17.86 35.13 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.793 -0.718 . . . . 54.22 112.497 -179.977 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 3.1 tpt -66.03 164.2 15.81 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.779 0.323 . . . . 72.23 110.883 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -52.05 147.38 7.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.26 -0.427 . . . . 73.24 110.868 -179.802 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.26 -31.95 70.7 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.149 -0.478 . . . . 50.12 110.899 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.0 -41.96 99.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.154 -0.475 . . . . 72.33 110.938 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 36.0 mm-40 -61.92 -44.61 96.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.154 -0.476 . . . . 72.14 110.918 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 6.6 t-105 -73.07 -31.32 64.32 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.156 -0.474 . . . . 71.22 110.889 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -73.32 -36.39 66.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.294 -0.412 . . . . 72.51 110.919 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -63.12 -38.09 89.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.158 -0.474 . . . . 61.24 110.851 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.66 ' HB1' ' CE ' ' A' ' 62' ' ' MET . . . -64.23 -43.66 94.27 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.207 -0.451 . . . . 54.34 111.062 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.2 -43.09 99.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.215 -0.448 . . . . 73.12 110.855 -179.89 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -73.66 -31.52 63.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.208 -0.451 . . . . 72.4 110.888 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -70.74 -36.41 73.13 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.23 -0.441 . . . . 75.11 110.89 -179.819 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.686 HD13 ' O ' ' A' ' 19' ' ' LEU . 3.1 tm? -71.91 -21.04 61.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.149 -0.478 . . . . 72.51 110.973 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 5.1 ptmt -74.85 -34.62 62.31 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.156 -0.475 . . . . 74.41 110.918 179.822 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.04 -27.17 48.71 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.212 -0.449 . . . . 74.05 110.875 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -75.42 2.12 12.24 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.207 -0.451 . . . . 74.31 110.916 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.423 ' O ' ' HB2' ' A' ' 70' ' ' PRO . 7.8 m-85 -118.81 -75.59 0.58 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.166 -0.47 . . . . 72.55 110.976 -179.842 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 12.0 mt -161.78 24.63 0.12 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.113 -0.494 . . . . 75.43 110.888 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 4.2 t80 49.21 89.5 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.185 -0.461 . . . . 71.41 110.852 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -125.32 111.95 15.78 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.151 -0.477 . . . . 74.25 110.87 179.87 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.27 -9.32 57.86 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.257 -0.429 . . . . 62.15 110.808 -179.747 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -82.39 -15.32 53.11 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.186 -0.461 . . . . 74.51 110.872 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.4 m -88.28 9.4 23.27 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.171 -0.468 . . . . 70.44 111.138 -179.883 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -79.91 100.04 7.87 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.183 -0.462 . . . . 73.33 110.883 179.92 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -167.5 160.85 13.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.231 -0.44 . . . . 64.43 110.896 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.89 -38.11 61.97 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.148 -0.478 . . . . 70.21 111.136 179.844 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.8 m120 -76.28 -49.05 18.03 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.299 -0.409 . . . . 35.31 110.825 -179.913 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 89.0 p -60.9 -22.55 64.44 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.162 -0.472 . . . . 74.02 110.864 -179.855 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.524 HD23 ' N ' ' A' ' 36' ' ' GLU . 0.6 OUTLIER -60.47 -44.49 95.84 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.125 -0.489 . . . . 72.52 110.895 -179.99 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.524 ' N ' HD23 ' A' ' 35' ' ' LEU . 0.7 OUTLIER -61.95 -51.05 69.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.244 -0.435 . . . . 73.13 110.944 179.897 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.7 -36.79 85.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.175 -0.466 . . . . 63.32 111.096 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.47 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 1.1 tttp -69.5 -49.16 57.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.191 -0.459 . . . . 72.32 110.869 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.783 HD11 HD22 ' A' ' 54' ' ' LEU . 2.1 mt -61.84 -35.62 78.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.251 -0.431 . . . . 72.11 110.909 179.968 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.74 -45.92 88.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.187 -0.461 . . . . 62.43 110.891 179.799 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.47 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 3.5 pt-20 -62.81 -32.43 73.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.26 -0.427 . . . . 75.11 110.841 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.433 ' HE3' ' CZ ' ' A' ' 46' ' ' PHE . 1.5 ttt -68.05 -34.25 76.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.18 -0.464 . . . . 63.43 110.868 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.479 ' CD ' HD11 ' A' ' 48' ' ' LEU . 2.6 mm100 -57.26 -39.22 75.19 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.265 -0.425 . . . . 74.45 110.983 -179.961 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.4 mmtt -68.78 -28.76 67.07 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.14 -0.482 . . . . 71.43 110.912 179.943 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -70.59 -43.84 68.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 73.32 110.881 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.443 ' CB ' HD23 ' A' ' 48' ' ' LEU . 10.3 m-85 -82.05 -34.92 29.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.157 -0.474 . . . . 70.43 110.873 -179.905 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 102.65 -8.36 54.54 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.785 -0.722 . . . . 64.34 112.575 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.479 HD11 ' CD ' ' A' ' 43' ' ' GLN . 0.9 OUTLIER -59.87 136.43 90.29 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.665 0.745 . . . . 64.11 110.874 -179.916 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.69 -51.8 0.37 Allowed 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.715 2.277 . . . . 74.5 112.369 179.823 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.475 HD12 HG23 ' A' ' 58' ' ' VAL . 0.9 OUTLIER -51.11 108.25 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.219 -0.446 . . . . 71.22 111.102 179.924 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 7.4 p -96.24 156.62 16.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.119 -0.492 . . . . 73.25 111.16 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 58.76 20.22 46.57 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.783 -0.722 . . . . 64.24 112.441 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.452 ' O ' HG11 ' A' ' 58' ' ' VAL . 28.4 mmt -104.99 142.76 34.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.856 0.36 . . . . 75.23 110.805 -179.919 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.783 HD22 HD11 ' A' ' 39' ' ' LEU . 32.4 tp -161.9 77.91 0.52 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.194 -0.457 . . . . 73.4 110.925 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -179.04 -29.8 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.198 -0.456 . . . . 44.35 110.869 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 26.7 t -91.45 -98.55 0.12 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.206 -0.452 . . . . 75.25 110.842 -179.886 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 11.1 tpt180 -84.8 -31.08 24.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.123 -0.49 . . . . 61.22 110.823 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.475 HG23 HD12 ' A' ' 50' ' ' ILE . 88.9 t -63.94 -43.27 97.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.158 -0.473 . . . . 70.12 111.159 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.445 HD13 ' HA ' ' A' ' 59' ' ' ILE . 0.4 OUTLIER -69.05 -30.83 47.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.12 -0.491 . . . . 74.43 111.188 179.921 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.52 -43.73 93.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.18 -0.464 . . . . 73.45 110.904 179.936 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.731 HG21 HG22 ' A' ' 215' ' ' THR . 0.0 OUTLIER -76.18 -29.82 19.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.092 -0.504 . . . . 74.52 111.123 179.973 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.66 ' CE ' ' HB1' ' A' ' 15' ' ' ALA . 10.1 mmm -68.91 -26.64 65.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.454 . . . . 74.01 110.84 179.845 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -100.07 -24.99 14.45 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.239 -0.437 . . . . 42.22 110.909 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 6.6 mtmp? -85.27 152.6 58.42 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.533 0.682 . . . . 65.34 110.929 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 152.45 69.35 Favored 'Trans proline' 0 N--CA 1.466 -0.138 0 C-N-CA 122.76 2.307 . . . . 72.11 112.303 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 2.1 ttm180 -147.99 -83.69 0.11 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.201 -0.454 . . . . 71.51 110.853 -179.901 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -145.72 156.57 43.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.184 -0.462 . . . . 55.3 110.882 -179.933 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.708 ' HA2' HG23 ' A' ' 155' ' ' THR . . . -94.98 9.81 70.29 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.704 -0.76 . . . . 64.23 112.51 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.515 HG12 ' HD2' ' A' ' 70' ' ' PRO . 0.2 OUTLIER -100.33 135.38 20.28 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.574 0.702 . . . . 74.23 111.157 -179.973 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.515 ' HD2' HG12 ' A' ' 69' ' ' VAL . 53.1 Cg_endo -69.77 159.81 52.0 Favored 'Trans proline' 0 N--CA 1.465 -0.196 0 C-N-CA 122.709 2.273 . . . . 63.44 112.369 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -94.37 6.66 48.05 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.272 -0.422 . . . . 74.45 110.862 179.969 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -156.68 145.77 11.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.159 -0.473 . . . . 53.43 111.137 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -130.86 170.4 14.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.455 . . . . 73.13 111.149 179.822 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -173.53 172.94 3.55 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.288 -0.415 . . . . 73.31 110.845 -179.901 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER 65.15 150.96 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.108 -0.496 . . . . 70.41 110.92 -179.908 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 30.2 m 63.01 109.96 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.151 -0.477 . . . . 74.2 110.912 -179.858 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -62.19 92.93 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.145 -0.48 . . . . 70.34 110.912 -179.943 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -50.38 157.8 1.15 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.717 0.77 . . . . 71.24 110.888 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.69 -177.82 2.03 Favored 'Trans proline' 0 C--N 1.343 0.239 0 C-N-CA 122.655 2.237 . . . . 73.34 112.363 180.0 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -86.92 146.42 26.17 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.218 -0.446 . . . . 74.43 110.892 179.969 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' SER . . . . . 0.408 ' HA ' ' HD2' ' A' ' 82' ' ' PRO . 6.5 m 63.63 94.78 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.671 0.748 . . . . 70.4 110.847 -179.798 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.408 ' HD2' ' HA ' ' A' ' 81' ' ' SER . 53.4 Cg_endo -69.79 -7.48 21.18 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.707 2.271 . . . . 71.11 112.363 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.683 ' HD3' HD22 ' A' ' 237' ' ' LEU . 9.7 mtpt -117.17 148.79 41.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.229 -0.441 . . . . 64.45 110.91 179.846 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' TRP . . . . . 0.545 ' CZ3' HG11 ' A' ' 89' ' ' VAL . 39.2 m0 -47.22 109.49 0.21 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.217 -0.447 . . . . 73.31 110.884 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.0 -5.28 11.97 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.261 -0.427 . . . . 65.3 111.151 -180.0 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -61.83 164.42 6.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 70.34 110.817 -179.844 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 11.5 mmtt -70.91 -30.66 67.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.056 -0.52 . . . . 71.12 110.953 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.422 ' HA ' ' O ' ' A' ' 123' ' ' HIS . 0.3 OUTLIER -154.02 144.92 14.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.258 -0.428 . . . . 74.14 111.092 179.879 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.545 HG11 ' CZ3' ' A' ' 84' ' ' TRP . 5.5 t -130.64 137.51 55.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.206 -0.452 . . . . 72.25 111.165 179.838 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.794 HG22 ' HB3' ' A' ' 125' ' ' ARG . 3.5 p -117.71 167.97 10.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 71.01 111.151 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.446 ' O ' HG21 ' A' ' 127' ' ' VAL . 3.7 p90 -150.05 146.58 27.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.251 -0.431 . . . . 70.51 110.93 -179.956 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.473 ' HB3' ' HB3' ' A' ' 132' ' ' ALA . 5.6 ttt-85 -149.43 139.75 22.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.113 -0.494 . . . . 71.25 110.811 -179.936 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.505 HD11 ' HA ' ' A' ' 106' ' ' ASP . 10.8 mm -74.75 134.47 29.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.144 -0.48 . . . . 72.4 111.176 179.866 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.71 HG22 ' SD ' ' A' ' 135' ' ' MET . 10.7 t -90.03 -40.68 13.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.465 . . . . 60.2 111.137 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 2.5 t -139.63 167.06 22.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.21 -0.45 . . . . 64.24 110.828 -179.813 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 15.6 p90 -114.93 149.96 36.44 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.115 -0.493 . . . . 72.25 110.945 -179.904 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.55 ' OG1' HG21 ' A' ' 105' ' ' VAL . 0.2 OUTLIER -83.22 140.98 32.22 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.114 -0.494 . . . . 64.11 111.113 -179.973 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.33 -8.47 55.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 72.14 110.806 -179.957 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -96.82 -25.61 15.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.252 -0.431 . . . . 74.13 110.818 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.658 HD21 ' HA ' ' A' ' 179' ' ' THR . 0.8 OUTLIER -135.84 153.44 77.18 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.632 0.73 . . . . 72.52 110.9 -179.944 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 101' ' ' PRO . . . . . 0.618 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.4 Cg_endo -69.79 151.12 68.81 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.666 2.244 . . . . 73.11 112.361 179.919 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 5.2 t-160 -53.96 -25.72 22.16 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.234 -0.439 . . . . 74.11 110.868 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.618 HG22 ' HB2' ' A' ' 101' ' ' PRO . 15.1 tt -75.57 -38.33 38.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.212 -0.449 . . . . 74.02 111.15 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 104' ' ' THR . . . . . 0.665 ' O ' HD22 ' A' ' 108' ' ' LEU . 3.1 m -69.2 -39.49 78.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.147 -0.479 . . . . 52.11 111.119 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.751 ' O ' HG13 ' A' ' 109' ' ' VAL . 92.9 t -72.93 -45.41 55.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.214 -0.448 . . . . 71.51 111.143 179.901 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.636 ' O ' HG22 ' A' ' 109' ' ' VAL . 49.8 t0 -61.5 -44.55 96.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.13 -0.486 . . . . 63.44 110.92 179.94 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 1.7 ptm180 -69.93 -33.55 72.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.171 -0.468 . . . . 75.02 110.854 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.665 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -60.64 -49.07 79.02 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.15 -0.477 . . . . 71.04 110.954 -179.97 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.751 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.4 m -55.61 -42.2 67.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.199 -0.455 . . . . 72.31 111.132 179.791 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.472 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 34.9 t -70.19 -34.16 72.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.157 -0.474 . . . . 72.14 110.889 -179.854 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.454 ' CG ' HD21 ' A' ' 189' ' ' LEU . 0.4 OUTLIER -62.56 -33.36 74.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.091 -0.504 . . . . 74.35 110.842 -179.998 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -95.09 -40.9 9.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.26 -0.427 . . . . 74.32 111.085 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.739 ' CD1' HD12 ' A' ' 196' ' ' LEU . 0.4 OUTLIER -65.65 -33.12 75.16 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.254 -0.43 . . . . 72.0 110.914 -179.982 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 29.6 t-20 -64.83 -40.95 96.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.177 -0.465 . . . . 72.34 110.861 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' MET . . . . . 0.72 ' O ' HD11 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -57.8 -34.62 69.83 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.158 -0.473 . . . . 54.12 110.895 179.953 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 9.1 m95 -66.73 -52.36 45.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.186 -0.461 . . . . 75.23 110.887 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' GLY . . . . . 0.457 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -59.96 -37.39 92.59 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.745 -0.74 . . . . 73.32 112.485 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.4 mmpt? -61.82 -16.86 53.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.777 0.322 . . . . 72.42 110.91 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.798 ' HG2' HD13 ' A' ' 226' ' ' LEU . 0.4 OUTLIER -101.01 13.27 35.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.249 -0.432 . . . . 75.24 110.885 179.96 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.457 ' CG1' ' HA2' ' A' ' 117' ' ' GLY . 2.2 pt -147.16 146.39 25.4 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.641 0.734 . . . . 71.34 111.156 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.72 6.22 1.38 Allowed 'Trans proline' 0 C--O 1.232 0.225 0 C-N-CA 122.809 2.339 . . . . 72.21 112.318 179.895 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.442 ' HA ' HD23 ' A' ' 122' ' ' LEU . 4.9 mt -62.52 -156.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.223 -0.444 . . . . 73.22 110.963 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.422 ' O ' ' HA ' ' A' ' 88' ' ' VAL . 12.3 t-80 -158.67 127.37 5.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.223 -0.444 . . . . 74.12 110.862 179.851 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 11.5 m-30 -110.49 142.85 41.7 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.191 -0.459 . . . . 75.54 110.907 -179.913 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.794 ' HB3' HG22 ' A' ' 90' ' ' THR . 0.0 OUTLIER -117.96 140.17 50.12 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.162 -0.472 . . . . 75.14 110.944 -179.968 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.79 142.18 32.83 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.228 -0.442 . . . . 72.22 110.868 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 127' ' ' VAL . . . . . 0.818 HG11 ' HB2' ' A' ' 132' ' ' ALA . 30.3 m -103.23 140.33 21.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.189 -0.459 . . . . 50.13 111.131 179.852 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.402 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -156.41 -27.54 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.205 -0.452 . . . . 74.43 111.129 179.941 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 129' ' ' TRP . . . . . 0.402 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -135.35 109.2 8.1 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.174 -0.467 . . . . 71.25 110.939 179.994 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.97 -158.52 14.83 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.757 -0.735 . . . . 62.11 112.498 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.9 156.29 17.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.8 0.333 . . . . 63.25 111.13 -179.841 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 132' ' ' ALA . . . . . 0.818 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -111.59 165.46 11.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.172 -0.467 . . . . 51.34 111.096 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -66.38 -62.58 1.39 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.23 -0.441 . . . . 75.41 110.907 179.953 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 134' ' ' ILE . . . . . 0.43 HG22 HD13 ' A' ' 136' ' ' ILE . 4.5 mp -82.72 142.55 13.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.112 -0.494 . . . . 70.51 111.148 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 135' ' ' MET . . . . . 0.71 ' SD ' HG22 ' A' ' 94' ' ' VAL . 27.9 mmt -113.14 119.25 37.18 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.172 -0.467 . . . . 72.43 110.843 179.861 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.438 HG21 HG11 ' A' ' 109' ' ' VAL . 1.0 OUTLIER -105.61 89.91 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.191 -0.459 . . . . 70.04 111.147 179.928 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -129.93 167.92 21.5 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.771 -0.728 . . . . 63.34 112.501 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 138' ' ' PHE . . . . . 0.562 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 32.7 m-85 -104.89 149.96 25.26 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.828 0.347 . . . . 74.01 110.848 -179.845 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.562 ' HB2' ' O ' ' A' ' 138' ' ' PHE . . . 169.59 165.93 0.05 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.158 -0.473 . . . . 71.21 111.08 179.851 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 4.6 ptt85 -109.45 174.27 5.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.227 -0.442 . . . . 62.21 110.908 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 141' ' ' GLY . . . . . 0.498 ' H ' ' HA ' ' A' ' 149' ' ' PHE . . . -55.03 -16.68 8.48 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.695 -0.764 . . . . 74.24 112.528 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 142' ' ' ALA . . . . . 0.502 ' HB2' ' CD2' ' A' ' 149' ' ' PHE . . . -91.45 13.13 18.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.817 0.342 . . . . 75.03 111.115 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 143' ' ' HIS . . . . . 0.467 ' HB3' ' HB1' ' A' ' 139' ' ' ALA . 4.1 p80 -80.52 -0.99 39.98 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.199 -0.455 . . . . 71.11 110.911 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 107.3 45.15 1.18 Allowed Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.719 -0.753 . . . . 45.51 112.408 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 39.9 p-10 -146.05 168.82 20.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.843 0.354 . . . . 72.14 110.877 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.0 164.96 9.62 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.142 -0.481 . . . . 51.25 110.881 -179.744 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 64.73 132.37 0.03 OUTLIER Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.65 0.738 . . . . 73.4 110.916 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.67 151.02 69.47 Favored 'Trans proline' 0 C--O 1.231 0.125 0 C-N-CA 122.715 2.276 . . . . 74.53 112.342 179.951 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 149' ' ' PHE . . . . . 0.502 ' CD2' ' HB2' ' A' ' 142' ' ' ALA . 7.0 p90 -53.94 -41.94 68.28 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.227 -0.442 . . . . 63.52 110.906 179.966 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 76.69 -22.69 0.27 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.118 -0.492 . . . . 63.11 110.861 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 151' ' ' GLY . . . . . 0.434 ' H ' ' C ' ' A' ' 149' ' ' PHE . . . 74.8 -149.55 39.94 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.812 -0.709 . . . . 71.41 112.472 -179.914 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.71 142.35 47.89 Favored 'Trans proline' 0 C--N 1.341 0.137 0 C-N-CA 122.666 2.244 . . . . 75.11 112.349 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 153' ' ' GLY . . . . . 0.448 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 104.34 -139.45 14.58 Favored Glycine 0 N--CA 1.453 -0.197 0 C-N-CA 120.669 -0.777 . . . . 70.32 112.456 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 154' ' ' ASN . . . . . 0.448 ' C ' ' O ' ' A' ' 153' ' ' GLY . 4.0 p30 -34.77 140.93 0.07 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.963 0.411 . . . . 73.25 110.895 -179.871 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 155' ' ' THR . . . . . 0.708 HG23 ' HA2' ' A' ' 68' ' ' GLY . 1.6 m 78.21 107.19 0.07 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.136 -0.484 . . . . 44.41 111.141 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 156' ' ' LEU . . . . . 0.995 HD21 HG21 ' A' ' 186' ' ' ILE . 0.8 OUTLIER -93.8 -54.69 3.52 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.211 -0.449 . . . . 75.02 110.921 179.921 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 157' ' ' ALA . . . . . 0.592 ' HB1' ' O ' ' A' ' 171' ' ' HIS . . . -158.56 148.0 19.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.177 -0.465 . . . . 71.42 111.069 179.843 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 26.5 p-80 -109.67 122.47 47.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.21 -0.45 . . . . 72.02 110.824 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.446 ' H ' HG22 ' A' ' 69' ' ' VAL . . . -109.59 160.63 16.09 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.221 -0.445 . . . . 74.42 111.13 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 11.8 m-85 -118.4 156.29 29.23 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.208 -0.451 . . . . 75.31 110.865 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 161' ' ' ALA . . . . . 0.739 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -82.85 165.29 42.42 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.543 0.687 . . . . 61.04 111.127 179.94 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 162' ' ' PRO . . . . . 0.739 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.6 Cg_endo -69.89 67.69 1.8 Allowed 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.668 2.246 . . . . 74.44 112.345 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -127.82 107.11 0.84 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.733 -0.746 . . . . 61.41 112.527 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 164' ' ' THR . . . . . 0.485 HG22 ' H ' ' A' ' 165' ' ' GLY . 0.2 OUTLIER 72.83 174.39 0.29 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.888 0.375 . . . . 73.1 111.119 -179.886 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 165' ' ' GLY . . . . . 0.485 ' H ' HG22 ' A' ' 164' ' ' THR . . . -50.06 -57.59 9.82 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.776 -0.725 . . . . 74.03 112.433 -179.99 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -60.48 -18.03 48.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.895 0.378 . . . . 65.12 110.964 -179.937 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -68.87 146.8 45.5 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.766 -0.731 . . . . 43.43 112.55 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 81.33 11.78 82.94 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.751 -0.738 . . . . 74.31 112.487 -179.871 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 57.6 m-20 -79.8 148.83 31.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.848 0.356 . . . . 63.41 110.802 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.26 130.41 55.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.148 -0.478 . . . . 74.21 111.084 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 171' ' ' HIS . . . . . 0.592 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 20.6 m170 -126.86 132.4 50.96 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.218 -0.446 . . . . 72.53 110.911 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 32.2 m-85 -113.7 139.56 48.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.268 -0.424 . . . . 71.44 110.841 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 55.0 t0 -71.63 100.69 2.35 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.129 -0.487 . . . . 74.11 110.809 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.71 -16.73 11.86 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.223 -0.444 . . . . 72.25 110.937 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -77.99 -16.26 58.27 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.104 -0.498 . . . . 73.32 110.911 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -85.05 -174.39 5.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.157 -0.474 . . . . 63.2 110.864 -179.873 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 6.4 mtt85 -112.33 115.14 28.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.156 -0.474 . . . . 63.14 110.85 -179.882 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 58.9 m95 -115.97 138.5 51.14 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.153 -0.476 . . . . 72.31 110.882 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 179' ' ' THR . . . . . 0.658 ' HA ' HD21 ' A' ' 100' ' ' LEU . 7.3 t -176.87 163.57 2.25 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.241 -0.436 . . . . 74.13 111.175 -179.974 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -125.06 -68.71 0.83 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.277 -0.419 . . . . 45.33 110.84 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -65.14 -11.68 52.59 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.757 -0.735 . . . . 62.41 112.479 -179.9 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 182' ' ' SER . . . . . 0.524 ' HB3' HG21 ' A' ' 179' ' ' THR . 0.3 OUTLIER -95.38 -24.24 16.8 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.845 0.355 . . . . 64.5 110.84 -179.698 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 183' ' ' SER . . . . . 0.429 ' C ' ' O ' ' A' ' 182' ' ' SER . 89.9 p 34.97 58.87 0.73 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.086 -0.506 . . . . 64.12 110.869 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 2.2 tp -116.73 -33.67 4.74 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.105 -0.498 . . . . 74.2 110.887 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -119.58 -138.41 5.71 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.754 -0.736 . . . . 73.01 112.489 179.915 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 186' ' ' ILE . . . . . 0.995 HG21 HD21 ' A' ' 156' ' ' LEU . 6.1 mm -79.51 98.75 3.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.897 0.379 . . . . 73.22 111.142 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -46.65 127.25 9.37 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.132 -0.486 . . . . 71.31 110.886 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 188' ' ' PHE . . . . . 0.718 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.2 t80 -60.66 -37.39 81.42 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.217 -0.447 . . . . 75.45 110.93 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 189' ' ' LEU . . . . . 0.454 HD21 ' CG ' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -66.7 -47.89 70.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.129 -0.487 . . . . 52.02 110.933 179.942 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 48.8 t80 -69.7 -38.57 77.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.464 . . . . 74.22 110.948 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 191' ' ' ALA . . . . . 0.643 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -72.88 -35.91 67.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.085 -0.507 . . . . 50.03 111.068 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 192' ' ' ALA . . . . . 0.692 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -57.26 -45.23 84.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.194 -0.457 . . . . 52.11 111.057 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 193' ' ' THR . . . . . 0.593 HG21 ' HE1' ' A' ' 224' ' ' PHE . 0.2 OUTLIER -58.39 -41.94 86.0 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.159 -0.473 . . . . 72.43 111.167 -179.883 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 4.9 t60 -72.71 -45.56 58.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.199 -0.455 . . . . 71.44 110.853 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -68.02 -47.96 67.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.202 -0.454 . . . . 71.01 111.079 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 196' ' ' LEU . . . . . 0.739 HD12 ' CD1' ' A' ' 113' ' ' LEU . 4.4 mm? -63.71 -37.32 86.92 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.199 -0.455 . . . . 74.51 110.954 -179.929 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -61.97 -26.46 67.33 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.783 -0.723 . . . . 52.23 112.541 179.855 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 198' ' ' HIS . . . . . 0.493 ' CD2' HG21 ' A' ' 69' ' ' VAL . 6.1 m-70 -68.83 -42.87 76.61 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.753 0.311 . . . . 75.21 110.84 -179.969 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.18 -27.59 65.82 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.452 . . . . 71.13 110.888 -179.765 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -84.78 0.17 51.66 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.041 -0.527 . . . . 64.13 110.938 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 88.36 -9.37 75.65 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.697 -0.764 . . . . 50.41 112.444 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 202' ' ' MET . . . . . 0.464 ' CE ' ' HB ' ' A' ' 234' ' ' ILE . 0.4 OUTLIER -60.33 127.14 30.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.838 0.352 . . . . 63.21 110.886 -179.995 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -101.03 178.86 28.44 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.781 -0.724 . . . . 64.44 112.486 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 18.4 m-70 -68.94 159.65 32.29 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.821 0.343 . . . . 74.32 110.86 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -122.25 157.36 31.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.204 -0.453 . . . . 53.34 110.807 -179.764 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -87.88 -4.43 58.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.084 -0.507 . . . . 72.22 110.863 -179.827 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.44 137.49 83.68 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.681 0.753 . . . . 65.11 110.871 179.943 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 -6.68 19.17 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.694 2.263 . . . . 74.53 112.348 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 -127.61 33.48 4.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.213 -0.449 . . . . 63.52 110.896 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 210' ' ' ALA . . . . . 0.51 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.14 145.99 26.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.156 -0.475 . . . . 62.23 111.104 179.851 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -73.47 -26.86 22.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.213 -0.449 . . . . 62.04 111.2 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 212' ' ' MET . . . . . 0.451 ' HE1' ' HB2' ' A' ' 202' ' ' MET . 16.3 tpp -94.76 6.94 47.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.14 -0.482 . . . . 75.22 110.846 179.953 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 213' ' ' TYR . . . . . 0.429 ' HB2' ' O ' ' A' ' 210' ' ' ALA . 0.1 OUTLIER -56.2 127.32 70.21 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.703 0.763 . . . . 73.43 110.929 -179.857 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.77 -29.57 23.63 Favored 'Trans proline' 0 C--O 1.231 0.159 0 C-N-CA 122.687 2.258 . . . . 63.01 112.357 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 215' ' ' THR . . . . . 0.731 HG22 HG21 ' A' ' 61' ' ' ILE . 60.4 p -84.42 62.23 7.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.214 -0.448 . . . . 74.24 111.205 179.964 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 -42.43 145.88 0.38 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.247 -0.433 . . . . 74.14 110.906 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -63.96 169.96 20.51 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.732 -0.747 . . . . 74.22 112.563 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 26.5 t30 -54.59 -74.03 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.895 0.378 . . . . 64.22 110.88 -179.884 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . -83.7 -142.89 5.22 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.791 -0.719 . . . . 72.24 112.512 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 220' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -120.12 153.58 55.47 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.645 0.736 . . . . 41.43 110.873 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.73 120.51 7.29 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.691 2.26 . . . . 73.42 112.378 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -54.44 -44.93 72.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 74.21 110.855 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -123.26 -36.04 2.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.238 -0.437 . . . . 60.33 110.86 -179.886 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 224' ' ' PHE . . . . . 0.593 ' HE1' HG21 ' A' ' 193' ' ' THR . 0.0 OUTLIER 65.92 129.58 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.166 -0.47 . . . . 65.01 110.901 -179.952 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -143.6 159.24 42.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.153 -0.476 . . . . 64.24 110.964 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 226' ' ' LEU . . . . . 0.798 HD13 ' HG2' ' A' ' 119' ' ' GLU . 29.9 mt -65.5 148.79 51.14 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.286 -0.415 . . . . 53.44 110.924 179.93 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 227' ' ' SER . . . . . 0.51 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 1.8 t -87.65 151.71 22.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.216 -0.447 . . . . 74.21 110.83 -179.922 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.54 -63.0 1.15 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.115 -0.493 . . . . 74.54 110.89 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -55.7 -27.47 50.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.163 -0.471 . . . . 72.22 110.842 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -70.58 -49.41 48.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.279 -0.418 . . . . 74.23 110.885 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 231' ' ' ILE . . . . . 0.707 HD11 ' HB3' ' A' ' 226' ' ' LEU . 9.5 mt -69.34 -45.03 79.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 73.41 111.101 179.972 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.21 -33.18 67.25 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.238 -0.437 . . . . 65.42 110.867 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -63.12 -49.49 71.09 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.81 -0.709 . . . . 63.43 112.467 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 234' ' ' ILE . . . . . 0.555 HD11 ' CE1' ' A' ' 238' ' ' TYR . 6.8 tt -72.59 -29.1 29.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.814 0.34 . . . . 71.54 111.16 180.0 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -60.23 -28.51 68.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.159 -0.473 . . . . 70.33 110.944 179.945 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 236' ' ' LYS . . . . . 0.442 ' HD3' ' N ' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.67 -27.3 60.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.241 -0.436 . . . . 51.21 110.92 179.915 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 237' ' ' LEU . . . . . 0.683 HD22 ' HD3' ' A' ' 83' ' ' LYS . 8.2 tt -97.48 -24.59 15.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.213 -0.449 . . . . 75.41 110.936 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 238' ' ' TYR . . . . . 0.555 ' CE1' HD11 ' A' ' 234' ' ' ILE . 3.8 m-85 -92.31 -35.38 13.78 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.452 . . . . 51.24 110.925 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -152.77 -117.31 0.69 Allowed Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.763 -0.732 . . . . 32.22 112.475 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -83.65 143.53 30.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.818 0.342 . . . . 75.42 110.886 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 5.9 ptm180 -78.8 -174.08 3.78 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.141 -0.482 . . . . 73.34 110.876 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 5.5 m -160.73 -43.77 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.131 -0.486 . . . . 62.42 110.778 -179.84 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 2.9 t30 -163.95 -171.95 2.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.216 -0.447 . . . . 72.13 110.851 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 10.1 p -98.91 -179.9 4.42 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.122 -0.49 . . . . 62.23 110.854 -179.861 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 30.2 ptt180 -167.72 -173.73 2.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.084 -0.507 . . . . 70.43 110.837 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 9.6 mmtm -143.97 140.2 29.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.191 -0.459 . . . . 72.11 110.847 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 15.5 tptm . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.185 -0.462 . . . . 74.13 110.87 179.856 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 302' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' -2' ' ' LEU . . . . . . . . . . . . . 2.7 tp . . . . . 0 C--O 1.231 0.087 0 CA-C-O 121.649 0.738 . . . . 73.02 110.908 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' -1' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.85 84.41 0.67 Allowed 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.724 2.283 . . . . 71.15 112.305 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 0' ' ' LEU . . . . . 0.494 ' N ' ' HD2' ' A' ' 1' ' ' PRO . 0.2 OUTLIER -59.45 -60.39 10.72 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-O 121.551 0.691 . . . . 62.13 110.904 179.995 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.494 ' HD2' ' N ' ' A' ' 0' ' ' LEU . 53.5 Cg_endo -69.72 -173.11 0.65 Allowed 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.685 2.257 . . . . 64.14 112.354 179.85 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -113.79 119.37 37.12 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.276 -0.42 . . . . 60.51 110.897 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -95.41 -22.57 17.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.275 -0.42 . . . . 74.01 110.887 -179.911 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.75 ' HB3' ' OD1' ' A' ' 55' ' ' ASN . . . -56.39 -33.95 66.25 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.115 -0.493 . . . . 71.4 111.109 179.865 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -55.8 -29.66 55.17 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.799 -0.715 . . . . 60.51 112.512 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -109.0 -8.62 27.42 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.741 -0.742 . . . . 54.22 112.497 -179.887 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 39.5 mtt -60.81 164.25 4.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.777 0.322 . . . . 72.23 110.872 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -81.29 168.61 18.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.203 -0.453 . . . . 73.24 110.858 -179.816 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -58.03 -31.86 67.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.125 -0.489 . . . . 50.12 110.927 179.936 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.9 mp -60.45 -42.67 96.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.131 -0.486 . . . . 72.33 110.945 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 69.3 mm-40 -61.71 -43.39 98.95 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.163 -0.472 . . . . 72.14 110.955 179.861 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 15.2 t-105 -73.15 -30.93 63.94 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.185 -0.461 . . . . 71.22 110.958 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -73.27 -35.26 66.15 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.236 -0.438 . . . . 72.51 110.825 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.98 -39.26 94.18 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.205 -0.452 . . . . 61.24 110.864 -179.876 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.22 -35.13 69.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.174 -0.466 . . . . 54.34 111.069 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.488 ' NE2' HD12 ' A' ' 35' ' ' LEU . 0.0 OUTLIER -67.31 -40.07 85.97 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.251 -0.431 . . . . 73.12 110.896 -179.899 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -77.18 -31.71 55.61 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.191 -0.459 . . . . 72.4 110.873 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -62.73 -36.16 82.09 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.185 -0.461 . . . . 75.11 110.926 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.745 HD13 ' O ' ' A' ' 19' ' ' LEU . 1.8 tm? -71.38 -21.04 62.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.124 -0.489 . . . . 72.51 110.896 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 4.4 ptmt -74.8 -29.81 61.22 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.206 -0.452 . . . . 74.41 110.928 179.829 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.6 ptp85 -86.59 -28.03 23.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.205 -0.452 . . . . 74.05 110.905 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 13.0 m-85 -68.82 -10.66 58.05 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.157 -0.474 . . . . 74.31 110.814 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.526 ' HB3' HG21 ' A' ' 72' ' ' VAL . 8.3 m-85 -120.34 -61.52 1.57 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.197 -0.456 . . . . 72.55 110.92 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.53 ' HG ' HG23 ' A' ' 72' ' ' VAL . 11.9 mt -161.49 -86.74 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.135 -0.484 . . . . 75.43 110.906 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -178.93 89.84 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.228 -0.442 . . . . 71.41 110.989 -179.989 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -116.36 90.41 3.33 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.158 -0.473 . . . . 74.25 110.809 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 11.6 p -85.37 -33.5 21.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.218 -0.446 . . . . 62.15 110.801 -179.77 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.4 pm0 -75.61 -13.04 60.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.213 -0.449 . . . . 74.51 110.913 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 68.0 m -76.96 -17.5 58.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.187 -0.46 . . . . 70.44 111.093 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.7 mtmp? -53.59 101.91 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.243 -0.435 . . . . 73.33 110.856 179.857 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -171.11 151.97 3.35 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.251 -0.431 . . . . 64.43 110.888 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.43 -20.0 66.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.146 -0.479 . . . . 70.21 111.168 179.835 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -85.04 -48.89 8.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.183 -0.462 . . . . 35.31 110.932 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -75.12 -21.36 58.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.131 -0.486 . . . . 74.02 110.837 -179.86 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.488 HD12 ' NE2' ' A' ' 16' ' ' GLN . 2.3 tt -63.33 -44.51 94.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.209 -0.451 . . . . 72.52 110.982 179.952 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.415 ' N ' HD23 ' A' ' 35' ' ' LEU . 0.1 OUTLIER -64.09 -51.22 65.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.184 -0.462 . . . . 73.13 110.872 179.935 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.5 -51.04 68.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.076 -0.511 . . . . 63.32 111.138 179.898 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.521 ' HD3' HD12 ' A' ' 19' ' ' LEU . 5.9 tttp -59.94 -49.35 78.03 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.222 -0.445 . . . . 72.32 110.891 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.42 ' O ' ' HG2' ' A' ' 43' ' ' GLN . 0.1 OUTLIER -58.04 -36.4 72.69 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.261 -0.427 . . . . 72.11 110.909 179.922 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.2 tttm -58.99 -45.7 90.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.151 -0.477 . . . . 62.43 110.847 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.484 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 3.2 pt-20 -60.58 -32.62 71.72 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.226 -0.443 . . . . 75.11 110.905 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 7.5 ttt -68.37 -33.99 75.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.197 -0.456 . . . . 63.43 110.892 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.767 ' OE1' HD11 ' A' ' 48' ' ' LEU . 1.3 mm-40 -61.33 -39.66 91.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.242 -0.435 . . . . 74.45 110.964 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.2 mmpt? -72.39 -32.97 66.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 71.43 110.862 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 56.3 t80 -70.63 -40.68 72.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.181 -0.463 . . . . 73.32 110.839 180.0 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.863 ' CZ ' HD13 ' A' ' 61' ' ' ILE . 3.3 m-85 -82.25 -35.16 28.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.185 -0.462 . . . . 70.43 110.819 -179.829 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 104.05 -10.17 51.34 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.784 -0.722 . . . . 64.34 112.489 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.767 HD11 ' OE1' ' A' ' 43' ' ' GLN . 0.8 OUTLIER -60.11 138.13 91.24 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.518 0.675 . . . . 64.11 110.936 -179.93 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.502 ' O ' HG23 ' A' ' 51' ' ' THR . 53.9 Cg_endo -69.77 -53.55 0.26 Allowed 'Trans proline' 0 C--O 1.231 0.151 0 C-N-CA 122.713 2.276 . . . . 74.5 112.35 179.853 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.508 ' CD1' HG23 ' A' ' 58' ' ' VAL . 0.9 OUTLIER -51.9 108.25 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 71.22 111.196 179.934 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.721 HG22 ' CB ' ' A' ' 43' ' ' GLN . 39.8 p -113.96 151.5 32.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.155 -0.475 . . . . 73.25 111.149 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 76.46 -0.61 63.84 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.756 -0.735 . . . . 64.24 112.528 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.511 ' O ' HG21 ' A' ' 58' ' ' VAL . 2.9 mtt -135.22 161.08 36.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.836 0.35 . . . . 75.23 110.892 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.72 ' CD1' HD13 ' A' ' 59' ' ' ILE . 2.8 pp -156.78 128.63 7.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.271 -0.422 . . . . 73.4 110.882 -179.945 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.75 ' OD1' ' HB3' ' A' ' 4' ' ' ALA . 2.4 t30 173.01 -28.67 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.165 -0.471 . . . . 44.35 110.836 179.816 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 23.1 p -96.85 -87.09 0.32 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.216 -0.447 . . . . 75.25 110.856 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.701 ' O ' HG23 ' A' ' 61' ' ' ILE . 0.1 OUTLIER -84.49 -34.77 23.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.187 -0.46 . . . . 61.22 110.864 -179.972 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.527 ' O ' HG13 ' A' ' 61' ' ' ILE . 14.1 t -59.94 -46.92 93.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.224 -0.444 . . . . 70.12 111.143 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.72 HD13 ' CD1' ' A' ' 54' ' ' LEU . 4.0 tp -75.61 -32.14 24.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.165 -0.471 . . . . 74.43 111.099 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -59.92 -44.24 94.42 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.208 -0.451 . . . . 73.45 110.884 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.863 HD13 ' CZ ' ' A' ' 46' ' ' PHE . 1.7 pp -67.94 -29.52 45.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.225 -0.443 . . . . 74.52 111.098 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 4.7 mmt -61.68 -39.16 90.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.192 -0.458 . . . . 74.01 110.806 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -90.26 -26.29 20.13 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.275 -0.421 . . . . 42.22 110.935 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 4.1 mtmp? -85.21 133.95 41.73 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.573 0.701 . . . . 65.34 110.864 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.7 149.85 67.83 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.69 2.26 . . . . 72.11 112.368 179.84 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.31 -78.63 0.2 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.198 -0.455 . . . . 71.51 110.875 -179.934 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 16.0 p -145.29 141.51 28.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.186 -0.461 . . . . 55.3 110.852 -179.931 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.573 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -90.32 17.2 55.16 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.768 -0.729 . . . . 64.23 112.518 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.686 HG12 ' HD2' ' A' ' 70' ' ' PRO . 0.0 OUTLIER -110.52 141.19 23.48 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.556 0.693 . . . . 74.23 111.154 -179.955 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.686 ' HD2' HG12 ' A' ' 69' ' ' VAL . 53.7 Cg_endo -69.75 -179.86 3.2 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.615 2.21 . . . . 63.44 112.367 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -139.33 27.33 2.32 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.211 -0.449 . . . . 74.45 110.902 179.917 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.53 HG23 ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -136.56 130.07 46.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.207 -0.451 . . . . 53.43 111.128 -179.943 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -130.7 170.35 14.44 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.206 -0.452 . . . . 73.13 111.093 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -161.24 172.73 16.15 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.152 -0.476 . . . . 73.31 110.851 -179.983 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -51.99 137.65 26.6 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.162 -0.472 . . . . 70.41 110.961 -179.895 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 179.79 179.3 0.52 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.172 -0.467 . . . . 74.2 110.94 -179.78 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -77.25 58.58 1.64 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.145 -0.48 . . . . 70.34 110.956 179.938 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -104.99 160.73 24.98 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.704 0.764 . . . . 71.24 110.885 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.81 -174.89 1.0 Allowed 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.733 2.289 . . . . 73.34 112.284 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 8.4 m-80 -128.29 97.3 4.7 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.17 -0.468 . . . . 74.43 110.925 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -179.91 121.99 0.22 Allowed Pre-proline 0 C--N 1.33 -0.258 0 CA-C-O 121.597 0.713 . . . . 70.4 110.854 -179.81 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.79 -47.14 0.98 Allowed 'Trans proline' 0 C--O 1.232 0.213 0 C-N-CA 122.659 2.24 . . . . 71.11 112.362 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.738 ' CD ' HD22 ' A' ' 237' ' ' LEU . 0.0 OUTLIER -140.07 -178.47 5.47 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.237 -0.438 . . . . 64.45 110.898 179.865 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 84' ' ' TRP . . . . . 0.7 ' CE3' HG21 ' A' ' 89' ' ' VAL . 38.1 m0 -59.11 109.77 0.92 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 73.31 110.958 179.926 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 12.0 t -104.49 -14.87 15.53 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.289 -0.414 . . . . 65.3 111.092 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -56.76 152.45 12.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.261 -0.427 . . . . 70.34 110.87 -179.867 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.95 -30.58 71.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.163 -0.471 . . . . 71.12 110.875 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -156.94 144.12 10.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.28 -0.418 . . . . 74.14 111.122 179.86 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.7 HG21 ' CE3' ' A' ' 84' ' ' TRP . 64.7 t -124.36 138.99 52.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.192 -0.458 . . . . 72.25 111.131 179.884 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.676 HG22 ' HB3' ' A' ' 125' ' ' ARG . 1.1 p -115.83 151.14 35.81 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.159 -0.473 . . . . 71.01 111.127 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 5.4 p90 -133.11 146.55 51.71 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.218 -0.447 . . . . 70.51 110.939 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -148.29 138.17 22.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.102 -0.499 . . . . 71.25 110.832 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.421 HD11 ' HA ' ' A' ' 106' ' ' ASP . 11.7 mm -77.59 135.18 26.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.167 -0.47 . . . . 72.4 111.141 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.458 ' HB ' ' HA3' ' A' ' 137' ' ' GLY . 15.3 t -91.37 -40.5 12.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.173 -0.467 . . . . 60.2 111.14 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 3.8 t -141.44 169.44 17.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.145 -0.479 . . . . 64.24 110.859 -179.755 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 12.2 p90 -117.27 150.34 38.95 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.177 -0.465 . . . . 72.25 110.94 -179.891 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.54 ' OG1' HG21 ' A' ' 105' ' ' VAL . 0.2 OUTLIER -82.87 141.06 32.53 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.145 -0.48 . . . . 64.11 111.17 -179.986 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 2.0 ptt180 -72.42 -8.07 53.09 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.207 -0.451 . . . . 72.14 110.852 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -96.63 -25.94 15.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.218 -0.446 . . . . 74.13 110.801 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.5 HD22 HG21 ' A' ' 104' ' ' THR . 0.7 OUTLIER -135.54 152.67 76.78 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.675 0.75 . . . . 72.52 110.902 -179.974 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 101' ' ' PRO . . . . . 0.599 ' HB2' HG22 ' A' ' 103' ' ' ILE . 54.1 Cg_endo -69.69 151.04 69.41 Favored 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.706 2.271 . . . . 73.11 112.336 179.915 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 6.0 t-160 -52.91 -25.71 12.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.191 -0.459 . . . . 74.11 110.884 179.877 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.599 HG22 ' HB2' ' A' ' 101' ' ' PRO . 13.9 tt -76.74 -39.14 31.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.223 -0.444 . . . . 74.02 111.153 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 104' ' ' THR . . . . . 0.647 ' O ' HD22 ' A' ' 108' ' ' LEU . 3.4 m -69.07 -40.06 78.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 52.11 111.179 179.938 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.746 HG13 ' CZ ' ' A' ' 188' ' ' PHE . 90.7 t -72.99 -45.35 55.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.213 -0.449 . . . . 71.51 111.137 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.625 ' O ' HG22 ' A' ' 109' ' ' VAL . 48.1 t0 -61.3 -45.11 95.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.164 -0.471 . . . . 63.44 110.835 179.873 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 4.7 ptm85 -69.71 -33.31 72.32 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.196 -0.457 . . . . 75.02 110.902 -179.873 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.647 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -60.38 -48.72 80.53 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.241 -0.436 . . . . 71.04 110.911 179.957 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.732 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.2 m -55.44 -41.89 64.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.173 -0.467 . . . . 72.31 111.104 179.824 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.471 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 47.2 t -70.0 -34.35 73.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.204 -0.453 . . . . 72.14 110.838 -179.787 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.456 ' CG ' HD21 ' A' ' 189' ' ' LEU . 0.4 OUTLIER -62.51 -33.4 74.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.186 -0.461 . . . . 74.35 110.906 179.939 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.416 ' CB ' ' HB3' ' A' ' 192' ' ' ALA . . . -93.27 -40.61 10.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.206 -0.452 . . . . 74.32 111.061 179.846 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.743 ' CD1' HD12 ' A' ' 196' ' ' LEU . 0.7 OUTLIER -64.85 -33.35 75.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.232 -0.44 . . . . 72.0 110.928 -179.937 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -67.31 -40.99 86.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.233 -0.44 . . . . 72.34 110.882 179.88 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' MET . . . . . 0.768 ' O ' HD11 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -57.93 -34.35 69.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.184 -0.462 . . . . 54.12 110.921 179.89 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 116' ' ' TRP . . . . . 0.451 ' O ' HG12 ' A' ' 120' ' ' ILE . 6.5 m95 -64.84 -49.6 69.95 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.172 -0.467 . . . . 75.23 110.938 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 117' ' ' GLY . . . . . 0.604 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -73.02 -24.92 74.96 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.801 -0.714 . . . . 73.32 112.468 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.444 ' HE3' ' HA ' ' A' ' 115' ' ' MET . 0.3 OUTLIER -64.52 -13.95 54.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.736 0.303 . . . . 72.42 110.921 -179.985 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.578 ' CD ' HG21 ' A' ' 231' ' ' ILE . 1.7 mm-40 -112.61 13.91 20.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.181 -0.463 . . . . 75.24 110.953 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.692 ' CD1' HD12 ' A' ' 122' ' ' LEU . 5.0 pt -148.25 150.08 33.78 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.679 0.752 . . . . 71.34 111.161 179.975 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 24.51 0.18 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.658 2.239 . . . . 72.21 112.377 179.872 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.692 HD12 ' CD1' ' A' ' 120' ' ' ILE . 8.3 mt -70.95 -155.03 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.107 -0.497 . . . . 73.22 110.92 179.938 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.404 ' H ' ' HB3' ' A' ' 122' ' ' LEU . 5.0 t-80 -172.53 121.51 0.42 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.136 -0.484 . . . . 74.12 110.871 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.9 m-85 -106.97 141.79 37.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.261 -0.427 . . . . 75.54 110.876 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.676 ' HB3' HG22 ' A' ' 90' ' ' THR . 0.0 OUTLIER -115.24 141.17 48.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.191 -0.459 . . . . 75.14 110.897 -179.931 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.88 140.09 35.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.153 -0.476 . . . . 72.22 110.864 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 127' ' ' VAL . . . . . 0.913 HG11 ' HB2' ' A' ' 132' ' ' ALA . 32.7 m -103.06 138.29 27.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.205 -0.452 . . . . 50.13 111.132 179.866 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.409 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -153.47 -27.66 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.166 -0.47 . . . . 74.43 111.107 179.966 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 129' ' ' TRP . . . . . 0.409 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -134.5 109.26 8.6 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.1 -0.5 . . . . 71.25 110.932 179.95 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.39 -160.5 14.05 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.737 -0.744 . . . . 62.11 112.538 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -101.83 155.64 18.01 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.829 0.347 . . . . 63.25 111.165 -179.883 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 132' ' ' ALA . . . . . 0.913 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -112.22 165.28 12.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.216 -0.447 . . . . 51.34 111.061 179.932 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -73.11 -57.03 4.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 75.41 110.834 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 134' ' ' ILE . . . . . 0.708 HG23 ' O ' ' A' ' 168' ' ' GLY . 7.0 mm -82.5 112.79 20.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.189 -0.459 . . . . 70.51 111.102 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 2.0 mmm -96.63 116.6 29.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.115 -0.493 . . . . 72.43 110.903 179.86 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.402 ' O ' HG23 ' A' ' 93' ' ' ILE . 0.8 OUTLIER -106.21 94.64 3.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.238 -0.437 . . . . 70.04 111.096 179.951 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 137' ' ' GLY . . . . . 0.458 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -134.31 169.46 23.02 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.748 -0.739 . . . . 63.34 112.514 179.856 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 138' ' ' PHE . . . . . 0.544 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 2.8 m-85 -105.13 149.83 25.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.847 0.356 . . . . 74.01 110.844 -179.864 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.544 ' HB2' ' O ' ' A' ' 138' ' ' PHE . . . 171.36 167.71 0.08 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.071 -0.513 . . . . 71.21 111.04 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.446 ' HB3' ' HB3' ' A' ' 149' ' ' PHE . 35.1 mtp180 -103.95 173.04 6.47 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.188 -0.46 . . . . 62.21 110.855 -179.883 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -57.34 -16.23 19.74 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.682 -0.77 . . . . 74.24 112.553 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -94.52 13.34 24.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.804 0.335 . . . . 75.03 111.075 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 143' ' ' HIS . . . . . 0.465 ' HB3' ' HB1' ' A' ' 139' ' ' ALA . 9.2 p80 -71.49 -9.35 58.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 71.11 110.854 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 116.9 50.03 0.41 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.739 -0.743 . . . . 45.51 112.458 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -162.56 170.7 18.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.851 0.358 . . . . 72.14 110.851 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -64.11 175.86 1.15 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.129 -0.487 . . . . 51.25 110.836 -179.719 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 11.2 m-85 64.37 119.36 0.02 OUTLIER Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.634 0.731 . . . . 73.4 110.95 -179.854 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.69 151.76 69.55 Favored 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.702 2.268 . . . . 74.53 112.327 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 149' ' ' PHE . . . . . 0.446 ' HB3' ' HB3' ' A' ' 140' ' ' ARG . 8.2 p90 -53.44 -42.7 67.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 63.52 110.867 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 75.55 -22.03 0.28 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.187 -0.46 . . . . 63.11 110.888 179.994 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 151' ' ' GLY . . . . . 0.444 ' H ' ' C ' ' A' ' 149' ' ' PHE . . . 75.64 -156.11 47.63 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.766 -0.731 . . . . 71.41 112.486 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -69.7 142.45 48.22 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.717 2.278 . . . . 75.11 112.362 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 153' ' ' GLY . . . . . 0.443 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 104.52 -137.27 13.52 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.719 -0.753 . . . . 70.32 112.466 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 154' ' ' ASN . . . . . 0.443 ' C ' ' O ' ' A' ' 153' ' ' GLY . 9.7 p30 -35.03 144.38 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.981 0.419 . . . . 73.25 110.919 -179.923 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 155' ' ' THR . . . . . 0.48 HG23 ' HA2' ' A' ' 68' ' ' GLY . 0.2 OUTLIER 73.49 106.75 0.07 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.178 -0.465 . . . . 44.41 111.119 -179.999 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 156' ' ' LEU . . . . . 0.987 HD21 HG21 ' A' ' 186' ' ' ILE . 0.6 OUTLIER -87.87 -55.16 3.88 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.2 -0.455 . . . . 75.02 110.873 179.962 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 157' ' ' ALA . . . . . 0.573 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -163.68 148.24 10.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.203 -0.453 . . . . 71.42 111.162 179.764 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 23.8 p-80 -107.01 128.95 54.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.234 -0.439 . . . . 72.02 110.912 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -109.84 160.33 16.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.195 -0.457 . . . . 74.42 111.078 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 10.7 m-30 -106.59 141.66 37.52 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.231 -0.441 . . . . 75.31 110.919 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 161' ' ' ALA . . . . . 0.687 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -73.85 163.48 68.08 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.57 0.7 . . . . 61.04 111.064 179.979 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 162' ' ' PRO . . . . . 0.687 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 52.8 Cg_endo -69.82 76.15 1.19 Allowed 'Trans proline' 0 C--N 1.341 0.136 0 C-N-CA 122.704 2.269 . . . . 74.44 112.31 -179.943 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -127.46 100.6 0.55 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.725 -0.75 . . . . 61.41 112.445 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 1.3 p 60.21 176.83 0.09 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.856 0.36 . . . . 73.1 111.144 -179.882 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -52.29 -47.94 54.86 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.733 -0.746 . . . . 74.03 112.439 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.17 -19.67 55.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.884 0.373 . . . . 65.12 110.925 -179.893 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -84.71 168.88 44.15 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.768 -0.729 . . . . 43.43 112.482 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 168' ' ' GLY . . . . . 0.708 ' O ' HG23 ' A' ' 134' ' ' ILE . . . 74.6 16.79 80.0 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.711 -0.757 . . . . 74.31 112.453 -179.916 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -77.33 150.2 35.21 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.818 0.342 . . . . 63.41 110.896 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.67 129.97 56.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.215 -0.448 . . . . 74.21 111.079 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 171' ' ' HIS . . . . . 0.528 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 28.6 m170 -131.3 132.32 44.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.229 -0.442 . . . . 72.53 110.883 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 51.4 m-85 -117.72 139.38 51.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.166 -0.47 . . . . 71.44 110.903 -179.891 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 59.0 t0 -71.35 98.86 1.85 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.164 -0.471 . . . . 74.11 110.88 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 1.7 pp20? -57.7 -16.33 10.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.225 -0.443 . . . . 72.25 110.859 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -78.95 -16.35 57.07 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.161 -0.472 . . . . 73.32 110.84 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 -82.11 -176.06 5.96 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.259 -0.428 . . . . 63.2 110.973 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 177' ' ' ARG . . . . . 0.436 ' HG3' ' HA3' ' A' ' 185' ' ' GLY . 4.3 ptp180 -116.82 111.86 20.31 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.219 -0.446 . . . . 63.14 110.944 -179.989 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 5.1 m95 -117.29 152.27 35.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.172 -0.467 . . . . 72.31 110.944 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 179' ' ' THR . . . . . 0.427 ' HA ' HD11 ' A' ' 100' ' ' LEU . 7.8 t 178.41 163.7 0.73 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.27 -0.423 . . . . 74.13 111.142 -179.958 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -120.55 -75.09 0.59 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.21 -0.45 . . . . 45.33 110.892 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -56.13 -20.18 26.91 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.721 -0.752 . . . . 62.41 112.486 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 182' ' ' SER . . . . . 0.447 ' O ' ' C ' ' A' ' 183' ' ' SER . 0.4 OUTLIER -90.9 -24.7 20.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.963 0.411 . . . . 64.5 110.935 -179.802 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 183' ' ' SER . . . . . 0.447 ' C ' ' O ' ' A' ' 182' ' ' SER . 12.9 p 34.45 47.96 0.25 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.06 -0.518 . . . . 64.12 110.873 -179.806 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 3.6 tp -105.42 -33.71 8.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.102 -0.499 . . . . 74.2 110.981 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 185' ' ' GLY . . . . . 0.436 ' HA3' ' HG3' ' A' ' 177' ' ' ARG . . . -114.39 -141.82 7.79 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.763 -0.732 . . . . 73.01 112.504 179.922 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 186' ' ' ILE . . . . . 0.987 HG21 HD21 ' A' ' 156' ' ' LEU . 10.5 mm -78.82 97.58 2.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.888 0.375 . . . . 73.22 111.134 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -46.57 119.5 2.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.168 -0.469 . . . . 71.31 110.838 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 188' ' ' PHE . . . . . 0.746 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 2.4 t80 -54.19 -36.46 63.45 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.474 . . . . 75.45 110.898 179.975 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 189' ' ' LEU . . . . . 0.456 HD21 ' CG ' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -67.11 -47.47 71.04 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.137 -0.483 . . . . 52.02 110.925 -179.965 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 58.3 t80 -69.07 -37.04 78.29 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.201 -0.454 . . . . 74.22 110.973 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 191' ' ' ALA . . . . . 0.579 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -72.81 -35.57 67.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.085 -0.507 . . . . 50.03 111.126 179.884 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 192' ' ' ALA . . . . . 0.679 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -56.73 -44.84 82.06 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.217 -0.447 . . . . 52.11 111.131 179.847 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 193' ' ' THR . . . . . 0.551 HG21 ' HE1' ' A' ' 224' ' ' PHE . 0.7 OUTLIER -58.65 -41.89 87.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.168 -0.469 . . . . 72.43 111.161 -179.892 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 2.6 t60 -72.83 -40.61 65.61 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.236 -0.438 . . . . 71.44 110.8 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -73.42 -47.44 41.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.181 -0.463 . . . . 71.01 111.061 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 196' ' ' LEU . . . . . 0.743 HD12 ' CD1' ' A' ' 113' ' ' LEU . 4.4 mm? -64.2 -43.42 95.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.211 -0.45 . . . . 74.51 110.942 -179.958 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -57.44 -28.2 59.12 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.706 -0.759 . . . . 52.23 112.473 179.907 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 198' ' ' HIS . . . . . . . . . . . . . 4.7 m-70 -66.5 -44.26 83.07 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.827 0.346 . . . . 75.21 110.871 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.42 -25.86 64.69 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.207 -0.451 . . . . 71.13 110.891 -179.824 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 1.5 mt -82.22 -3.07 54.33 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.161 -0.472 . . . . 64.13 110.879 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 88.96 -5.64 84.36 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.807 -0.711 . . . . 50.41 112.565 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 202' ' ' MET . . . . . 0.438 ' SD ' HD12 ' A' ' 234' ' ' ILE . 2.2 mtp -61.93 134.97 57.34 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.815 0.34 . . . . 63.21 110.907 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -101.17 177.11 27.32 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.787 -0.721 . . . . 64.44 112.494 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 17.9 m-70 -70.26 160.76 31.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.782 0.325 . . . . 74.32 110.868 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 205' ' ' SER . . . . . 0.476 ' OG ' ' HB1' ' A' ' 210' ' ' ALA . 0.0 OUTLIER -121.39 151.72 39.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.194 -0.457 . . . . 53.34 110.827 -179.768 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 2.0 p -87.73 -4.63 58.89 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.178 -0.465 . . . . 72.22 110.818 -179.834 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.83 137.9 82.63 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.646 0.736 . . . . 65.11 110.791 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 -7.61 21.49 Favored 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.641 2.227 . . . . 74.53 112.311 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -126.08 29.79 5.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.26 -0.427 . . . . 63.52 110.862 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 210' ' ' ALA . . . . . 0.476 ' HB1' ' OG ' ' A' ' 205' ' ' SER . . . -87.34 145.76 26.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.123 -0.489 . . . . 62.23 111.112 179.878 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -69.69 -28.57 37.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.185 -0.461 . . . . 62.04 111.08 -179.929 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 14.0 tpp -96.48 10.49 38.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.177 -0.465 . . . . 75.22 110.953 179.884 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 213' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -55.69 115.05 8.5 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.629 0.728 . . . . 73.43 110.862 -179.791 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.78 -18.11 37.12 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.661 2.24 . . . . 63.01 112.353 179.878 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 215' ' ' THR . . . . . 0.477 HG23 ' CG2' ' A' ' 61' ' ' ILE . 0.3 OUTLIER -84.2 52.95 2.46 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.254 -0.43 . . . . 74.24 111.165 -179.991 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -74.75 124.81 27.47 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.163 -0.471 . . . . 74.14 110.912 -179.861 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . 163.08 103.03 0.17 Allowed Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.801 -0.714 . . . . 74.22 112.51 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -179.55 -73.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.888 0.375 . . . . 64.22 110.911 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . -142.36 -179.4 19.22 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.791 -0.719 . . . . 72.24 112.514 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 220' ' ' ASP . . . . . . . . . . . . . 54.7 m-20 -89.53 146.66 36.22 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.59 0.709 . . . . 41.43 110.848 -179.947 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.8 114.08 3.59 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.643 2.229 . . . . 73.42 112.331 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.62 -45.42 15.83 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.235 -0.438 . . . . 74.21 110.891 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 8.8 m-20 -130.43 -40.12 1.28 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.224 -0.443 . . . . 60.33 110.921 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 224' ' ' PHE . . . . . 0.551 ' HE1' HG21 ' A' ' 193' ' ' THR . 0.0 OUTLIER 65.67 127.24 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.139 -0.482 . . . . 65.01 110.895 179.973 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -143.76 161.0 39.73 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.166 -0.47 . . . . 64.24 110.907 179.941 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 226' ' ' LEU . . . . . 0.768 HD11 ' O ' ' A' ' 115' ' ' MET . 36.3 mt -64.38 147.99 51.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.272 -0.422 . . . . 53.44 110.849 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 227' ' ' SER . . . . . 0.463 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 0.9 OUTLIER -87.73 150.86 23.34 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.106 -0.497 . . . . 74.21 110.832 -179.924 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 -65.08 -66.8 0.5 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.18 -0.464 . . . . 74.54 110.922 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -55.37 -26.02 38.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.208 -0.451 . . . . 72.22 110.902 179.932 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -70.37 -49.04 53.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.156 -0.474 . . . . 74.23 110.868 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 231' ' ' ILE . . . . . 0.679 HD11 ' HB3' ' A' ' 226' ' ' LEU . 9.4 mt -69.4 -44.18 80.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.263 -0.426 . . . . 73.41 111.12 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.8 -31.98 65.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.142 -0.481 . . . . 65.42 110.932 179.86 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -70.13 -46.05 52.91 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.72 -0.753 . . . . 63.43 112.48 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 234' ' ' ILE . . . . . 0.438 HD12 ' SD ' ' A' ' 202' ' ' MET . 15.1 tt -73.18 -32.94 40.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.784 0.326 . . . . 71.54 111.114 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -66.33 -24.35 66.51 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.147 -0.479 . . . . 70.33 110.954 179.904 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 236' ' ' LYS . . . . . 0.46 ' HD3' ' N ' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.04 -28.97 61.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.172 -0.467 . . . . 51.21 110.829 -179.983 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 237' ' ' LEU . . . . . 0.738 HD22 ' CD ' ' A' ' 83' ' ' LYS . 5.7 tt -97.09 -23.61 16.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.251 -0.431 . . . . 75.41 110.925 179.952 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 238' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -92.45 -35.53 13.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.17 -0.468 . . . . 51.24 110.927 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -157.48 -116.31 0.49 Allowed Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.724 -0.75 . . . . 32.22 112.451 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 6.7 tttm -100.2 129.82 46.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.803 0.335 . . . . 75.42 110.894 -179.931 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 5.6 ptm180 -59.42 175.76 0.31 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.289 -0.414 . . . . 73.34 110.842 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -129.75 -177.91 4.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.23 -0.441 . . . . 62.42 110.909 -179.845 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -126.75 121.81 33.07 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.199 -0.455 . . . . 72.13 110.918 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 30.9 t -174.79 164.3 3.52 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.153 -0.476 . . . . 62.23 110.883 -179.877 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -172.0 163.01 6.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.125 -0.489 . . . . 70.43 110.921 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -175.57 38.24 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.202 -0.454 . . . . 72.11 110.87 179.954 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.16 -0.473 . . . . 74.13 110.937 179.874 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 302' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 21.1 t-105 . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.747 0.308 . . . . 71.22 110.898 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 49.7 tt0 -73.3 -35.46 66.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.267 -0.424 . . . . 72.51 110.852 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 13.3 mt-30 -62.92 -36.83 84.67 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.206 -0.452 . . . . 61.24 110.903 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.774 ' HB1' ' HE3' ' A' ' 62' ' ' MET . . . -57.1 -35.16 69.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.202 -0.454 . . . . 54.34 111.117 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.719 ' NE2' HD12 ' A' ' 35' ' ' LEU . 0.8 OUTLIER -64.78 -42.91 94.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.149 -0.478 . . . . 73.12 110.912 -179.914 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -76.99 -31.48 56.53 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.19 -0.459 . . . . 72.4 110.87 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -60.33 -44.08 95.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.159 -0.473 . . . . 75.11 110.907 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.654 HD13 ' O ' ' A' ' 19' ' ' LEU . 3.0 tm? -71.43 -22.27 61.87 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.138 -0.483 . . . . 72.51 110.862 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.452 ' HE2' ' HA ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -72.3 -43.75 63.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.2 -0.455 . . . . 74.41 110.919 179.816 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.452 ' HA ' ' HE2' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -70.25 -27.84 64.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.445 . . . . 74.05 110.853 179.999 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -74.09 -5.72 43.33 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.21 -0.45 . . . . 74.31 110.852 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.163 -0.471 . . . . 72.55 110.943 -179.907 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.719 HD12 ' NE2' ' A' ' 16' ' ' GLN . 7.3 tt . . . . . 0 N--CA 1.458 -0.048 0 CA-C-O 120.76 0.314 . . . . 72.52 110.913 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.93 -51.12 65.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.136 -0.484 . . . . 73.13 110.857 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.31 -50.48 69.9 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.177 -0.465 . . . . 63.32 111.097 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.462 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 24.4 mmmt -59.95 -49.51 77.39 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.226 -0.443 . . . . 72.32 110.896 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.905 HD11 HD22 ' A' ' 54' ' ' LEU . 0.1 OUTLIER -56.67 -36.99 70.21 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.266 -0.425 . . . . 72.11 110.894 179.917 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.5 ttmt -58.99 -45.5 90.48 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.451 . . . . 62.43 110.856 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.462 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 2.9 pt-20 -60.58 -32.84 71.92 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.247 -0.433 . . . . 75.11 110.827 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 7.2 ttt -68.47 -34.0 75.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.171 -0.468 . . . . 63.43 110.876 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.46 ' HG3' ' HA ' ' A' ' 51' ' ' THR . 2.3 mm100 -60.65 -39.98 90.33 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.215 -0.448 . . . . 74.45 110.916 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.2 mmpt? -70.58 -33.13 70.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 71.43 110.9 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 38.4 t80 -70.77 -37.33 73.36 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.232 -0.44 . . . . 73.32 110.903 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.727 ' HB3' HD23 ' A' ' 48' ' ' LEU . 2.7 m-85 -81.91 -35.63 28.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.108 -0.496 . . . . 70.43 110.869 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.447 ' HA2' ' HB3' ' A' ' 206' ' ' SER . . . 102.98 -10.2 55.41 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.742 -0.742 . . . . 64.34 112.51 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.727 HD23 ' HB3' ' A' ' 46' ' ' PHE . 0.7 OUTLIER -61.84 139.76 95.55 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.644 0.735 . . . . 64.11 110.898 -179.926 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.77 -53.23 0.28 Allowed 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.68 2.253 . . . . 74.5 112.318 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.649 HD12 HG23 ' A' ' 58' ' ' VAL . 0.9 OUTLIER -50.64 108.27 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.209 -0.451 . . . . 71.22 111.129 179.94 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.46 ' HA ' ' HG3' ' A' ' 43' ' ' GLN . 1.2 p -96.81 155.56 16.72 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.199 -0.455 . . . . 73.25 111.138 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 57.68 20.63 40.13 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.736 -0.745 . . . . 64.24 112.49 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . 0.423 ' O ' HG11 ' A' ' 58' ' ' VAL . 2.0 mtt -99.81 158.91 15.46 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.759 0.314 . . . . 75.23 110.917 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.905 HD22 HD11 ' A' ' 39' ' ' LEU . 23.4 tp -174.63 78.54 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.287 -0.415 . . . . 73.4 110.928 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 178.8 -31.22 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.242 -0.435 . . . . 44.35 110.905 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 8.5 m -91.14 -99.81 0.11 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.159 -0.473 . . . . 75.25 110.867 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 42.6 ttt85 -84.96 -29.36 25.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.11 -0.496 . . . . 61.22 110.857 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.649 HG23 HD12 ' A' ' 50' ' ' ILE . 93.1 t -64.23 -41.61 92.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.208 -0.451 . . . . 70.12 111.117 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.606 HD12 ' CD1' ' A' ' 54' ' ' LEU . 0.1 OUTLIER -75.09 -31.72 25.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.192 -0.458 . . . . 74.43 111.11 179.938 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -63.58 -44.39 94.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.186 -0.461 . . . . 73.45 110.863 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.657 HD12 ' CE2' ' A' ' 46' ' ' PHE . 24.3 pt -67.32 -30.1 47.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 74.52 111.132 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . 0.774 ' HE3' ' HB1' ' A' ' 15' ' ' ALA . 1.5 mmm -66.03 -36.22 82.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.159 -0.473 . . . . 74.01 110.931 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -87.74 -22.74 24.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 42.22 110.916 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 34.7 mttp -80.4 145.11 58.8 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.561 0.696 . . . . 65.34 110.888 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.81 161.08 47.31 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.689 2.259 . . . . 72.11 112.358 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.408 ' HG3' ' HA ' ' A' ' 214' ' ' PRO . 29.0 ttp180 -161.65 -82.5 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.195 -0.457 . . . . 71.51 110.903 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -145.36 156.45 43.79 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.175 -0.466 . . . . 55.3 110.878 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.652 ' HA2' HG23 ' A' ' 155' ' ' THR . . . -96.79 14.23 64.28 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.721 -0.752 . . . . 64.23 112.452 -179.862 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.696 HG12 ' HD2' ' A' ' 70' ' ' PRO . 0.0 OUTLIER -111.22 142.09 25.68 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.636 0.731 . . . . 74.23 111.098 179.996 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . 0.696 ' HD2' HG12 ' A' ' 69' ' ' VAL . 53.7 Cg_endo -69.82 178.21 4.84 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.65 2.234 . . . . 63.44 112.367 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -107.97 -2.9 19.31 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.25 -0.432 . . . . 74.45 110.841 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.224 -0.443 . . . . 53.43 111.166 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 C--O 1.232 0.182 0 CA-C-O 120.836 0.265 . . . . 71.11 112.309 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.703 ' CE ' HD13 ' A' ' 237' ' ' LEU . 8.5 mttp -83.31 168.43 16.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.252 -0.431 . . . . 64.45 110.913 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . 0.508 ' CD1' ' HA ' ' A' ' 200' ' ' LEU . 35.4 m95 -53.55 131.78 39.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.248 -0.433 . . . . 73.31 110.957 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.23 1.03 13.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.272 -0.422 . . . . 65.3 111.154 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.2 m -73.39 178.28 4.68 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.237 -0.438 . . . . 70.34 110.843 -179.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.81 -10.22 22.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.135 -0.484 . . . . 71.12 110.882 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -156.18 142.85 10.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.221 -0.445 . . . . 74.14 111.073 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 76.8 t -116.65 130.33 71.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.15 -0.477 . . . . 72.25 111.081 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.498 HG23 ' HB3' ' A' ' 125' ' ' ARG . 0.0 OUTLIER -118.45 144.57 45.89 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.115 -0.493 . . . . 71.01 111.124 -179.967 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 4.6 p90 -137.62 146.38 43.87 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.202 -0.454 . . . . 70.51 110.937 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 6.1 ttt180 -149.4 131.68 15.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.113 -0.494 . . . . 71.25 110.833 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.484 ' H ' HD12 ' A' ' 93' ' ' ILE . 4.8 mp -75.18 132.52 33.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.191 -0.459 . . . . 72.4 111.13 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 21.6 t -86.25 -40.25 14.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.163 -0.471 . . . . 60.2 111.112 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 92.0 p -156.42 169.34 24.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.172 -0.467 . . . . 64.24 110.818 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 11.5 p90 -125.39 154.98 41.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.126 -0.488 . . . . 72.25 110.911 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.9 t -96.59 141.14 30.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.159 -0.473 . . . . 64.11 111.097 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 2.6 mmp_? -53.06 -18.22 1.97 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 72.14 110.827 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.94 -35.92 82.71 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.196 -0.456 . . . . 74.13 110.894 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.51 HD22 HG21 ' A' ' 104' ' ' THR . 1.0 OUTLIER -141.86 153.7 64.65 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.602 0.715 . . . . 72.52 110.89 -179.987 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . 0.564 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.6 Cg_endo -69.77 151.02 68.88 Favored 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.692 2.262 . . . . 73.11 112.356 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 11.8 t-160 -52.36 -27.6 16.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.229 -0.441 . . . . 74.11 110.833 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.564 HG22 ' HB2' ' A' ' 101' ' ' PRO . 0.0 OUTLIER -75.37 -40.5 42.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.232 -0.44 . . . . 74.02 111.141 179.991 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . 0.651 ' O ' HD22 ' A' ' 108' ' ' LEU . 3.6 m -69.83 -38.42 76.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.138 -0.483 . . . . 52.11 111.184 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.797 ' O ' HG13 ' A' ' 109' ' ' VAL . 81.3 t -72.81 -45.55 56.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.173 -0.467 . . . . 71.51 111.134 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.674 ' O ' HG22 ' A' ' 109' ' ' VAL . 2.6 t0 -63.41 -42.6 98.77 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.183 -0.462 . . . . 63.44 110.829 179.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 11.2 ptm180 -70.11 -34.15 72.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.462 . . . . 75.02 110.87 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.651 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -62.08 -48.73 78.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.217 -0.447 . . . . 71.04 110.914 -179.969 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.797 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.5 m -55.4 -42.12 65.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.454 . . . . 72.31 111.114 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.469 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 48.0 t -70.22 -33.36 71.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.223 -0.444 . . . . 72.14 110.894 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.417 ' HB3' HD21 ' A' ' 189' ' ' LEU . 0.3 OUTLIER -61.84 -32.82 73.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.15 -0.477 . . . . 74.35 110.876 179.964 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -97.48 -40.31 8.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.198 -0.456 . . . . 74.32 111.059 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.843 HD12 HD12 ' A' ' 196' ' ' LEU . 0.3 OUTLIER -65.26 -33.58 76.33 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.243 -0.435 . . . . 72.0 110.88 -179.943 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 46.6 t30 -69.74 -40.55 76.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 72.34 110.9 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . 0.72 ' HB3' HD23 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -58.86 -34.56 71.75 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.206 -0.452 . . . . 54.12 110.868 179.91 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 7.8 m95 -66.45 -41.33 89.25 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.211 -0.45 . . . . 75.23 110.915 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -72.72 -38.85 56.66 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.761 -0.733 . . . . 73.32 112.471 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.0 mmpt? -62.66 -16.3 56.28 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.758 0.313 . . . . 72.42 110.921 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.619 ' HB3' HG23 ' A' ' 231' ' ' ILE . 37.2 mm-40 -100.4 13.33 34.83 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.222 -0.444 . . . . 75.24 110.892 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 0.8 HD12 HD12 ' A' ' 122' ' ' LEU . 6.4 pt -148.09 152.62 40.22 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.601 0.715 . . . . 71.34 111.136 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.74 1.21 4.63 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.685 2.257 . . . . 72.21 112.325 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.8 HD12 HD12 ' A' ' 120' ' ' ILE . 4.3 mt -62.63 -156.61 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.228 -0.442 . . . . 73.22 110.936 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 5.7 t60 -160.56 142.61 12.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.151 -0.477 . . . . 74.12 110.837 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 28.5 m-85 -121.59 148.52 44.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.182 -0.463 . . . . 75.54 110.849 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.498 ' HB3' HG23 ' A' ' 90' ' ' THR . 0.2 OUTLIER -126.97 141.69 51.73 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.136 -0.484 . . . . 75.14 110.93 -179.949 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . 0.57 ' HE3' HG13 ' A' ' 128' ' ' VAL . 0.1 OUTLIER -80.63 148.61 30.18 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.235 -0.439 . . . . 72.22 110.937 179.967 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . 0.898 HG11 ' HB2' ' A' ' 132' ' ' ALA . 25.6 m -103.14 126.31 57.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.278 -0.419 . . . . 50.13 111.087 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.602 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -144.34 -11.11 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.163 -0.471 . . . . 74.43 111.081 179.945 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' TRP . . . . . 0.602 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -157.44 109.17 2.35 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.193 -0.458 . . . . 71.25 110.949 179.981 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 109.77 -162.65 12.62 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.758 -0.734 . . . . 62.11 112.485 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 9.7 p -101.96 156.06 17.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.759 0.314 . . . . 63.25 111.13 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . 0.898 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -111.77 165.39 12.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.186 -0.461 . . . . 51.34 111.098 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -71.88 -55.13 8.07 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.22 -0.445 . . . . 75.41 110.825 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . 0.436 HD12 ' N ' ' A' ' 134' ' ' ILE . 5.0 mp -95.37 108.8 21.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.251 -0.432 . . . . 70.51 111.114 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 14.2 mmm -90.76 127.75 36.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.189 -0.459 . . . . 72.43 110.941 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.42 ' O ' HG23 ' A' ' 93' ' ' ILE . 0.8 OUTLIER -106.24 95.14 3.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.263 -0.426 . . . . 70.04 111.147 179.948 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -132.06 163.52 23.88 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.753 -0.737 . . . . 63.34 112.517 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' PHE . . . . . 0.487 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 49.9 m-85 -105.22 150.03 25.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.864 0.364 . . . . 74.01 110.885 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.566 ' HB1' ' CB ' ' A' ' 143' ' ' HIS . . . 174.45 166.89 0.24 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.107 -0.497 . . . . 71.21 111.122 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.403 ' HB3' ' HB3' ' A' ' 149' ' ' PHE . 29.4 mtm180 -104.41 173.2 6.4 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.211 -0.45 . . . . 62.21 110.865 -179.883 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -57.28 -15.91 17.82 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.758 -0.734 . . . . 74.24 112.464 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -96.51 13.3 28.49 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.756 0.312 . . . . 75.03 111.039 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' HIS . . . . . 0.566 ' CB ' ' HB1' ' A' ' 139' ' ' ALA . 4.1 p80 -75.81 -5.15 44.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.245 -0.434 . . . . 71.11 110.862 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 121.37 20.41 3.28 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.741 -0.742 . . . . 45.51 112.498 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -124.76 173.31 8.66 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.843 0.354 . . . . 72.14 110.864 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 20.5 m -75.42 170.51 15.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.196 -0.456 . . . . 51.25 110.846 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 64.89 132.57 0.03 OUTLIER Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.703 0.763 . . . . 73.4 110.928 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 152.01 69.11 Favored 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.708 2.272 . . . . 74.53 112.372 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 149' ' ' PHE . . . . . 0.443 ' C ' ' H ' ' A' ' 151' ' ' GLY . 21.3 p90 -53.01 -41.4 64.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.243 -0.435 . . . . 63.52 110.877 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 76.19 -25.13 0.21 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.171 -0.468 . . . . 63.11 110.902 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . 0.443 ' H ' ' C ' ' A' ' 149' ' ' PHE . . . 77.07 -151.35 38.68 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.74 -0.743 . . . . 71.41 112.481 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.75 142.15 47.18 Favored 'Trans proline' 0 C--N 1.341 0.137 0 C-N-CA 122.704 2.269 . . . . 75.11 112.333 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . 0.434 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 104.15 -137.19 13.43 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.725 -0.75 . . . . 70.32 112.418 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 154' ' ' ASN . . . . . 0.434 ' C ' ' O ' ' A' ' 153' ' ' GLY . 4.1 p30 -34.53 138.09 0.11 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.955 0.407 . . . . 73.25 110.886 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 155' ' ' THR . . . . . 0.652 HG23 ' HA2' ' A' ' 68' ' ' GLY . 1.5 m 73.29 112.23 0.06 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.166 -0.47 . . . . 44.41 111.171 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 156' ' ' LEU . . . . . 1.042 HD21 HG21 ' A' ' 186' ' ' ILE . 0.6 OUTLIER -94.92 -53.09 3.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.244 -0.434 . . . . 75.02 110.918 179.975 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . 0.548 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -163.85 148.58 10.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.201 -0.454 . . . . 71.42 111.107 179.773 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 16.1 p-80 -106.8 124.37 49.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 72.02 110.917 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -110.48 152.39 26.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.254 -0.43 . . . . 74.42 111.108 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -105.46 151.86 23.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.231 -0.44 . . . . 75.31 110.876 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 161' ' ' ALA . . . . . 0.702 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -82.79 164.06 48.56 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.581 0.705 . . . . 61.04 111.111 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 162' ' ' PRO . . . . . 0.702 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.9 Cg_endo -69.79 79.17 0.97 Allowed 'Trans proline' 0 C--N 1.34 0.127 0 C-N-CA 122.661 2.241 . . . . 74.44 112.347 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -137.98 124.71 3.03 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.73 -0.748 . . . . 61.41 112.497 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 63.31 -171.1 0.17 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.797 0.332 . . . . 73.1 111.135 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -86.0 -41.32 7.17 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.74 -0.743 . . . . 74.03 112.465 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 166' ' ' LEU . . . . . 0.43 ' C ' HD23 ' A' ' 166' ' ' LEU . 10.2 tt -71.32 -37.21 71.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.837 0.351 . . . . 65.12 110.913 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -79.11 161.24 47.12 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.766 -0.731 . . . . 43.43 112.488 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 91.29 23.08 30.24 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.765 -0.731 . . . . 74.31 112.54 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -94.42 167.03 11.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.848 0.356 . . . . 63.41 110.878 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.46 130.69 55.9 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.207 -0.451 . . . . 74.21 111.105 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 24.6 m170 -126.29 158.6 35.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.225 -0.443 . . . . 72.53 110.881 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -142.99 138.83 30.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.208 -0.451 . . . . 71.44 110.85 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 59.2 t0 -69.21 97.8 0.96 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.138 -0.483 . . . . 74.11 110.887 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.41 -17.04 10.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.228 -0.442 . . . . 72.25 110.844 -179.869 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -78.97 -16.12 57.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.464 . . . . 73.32 110.824 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -80.13 -174.96 4.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.229 -0.441 . . . . 63.2 110.911 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 24.7 mtm-85 -109.41 107.23 17.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 63.14 110.877 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 68.2 m95 -108.56 137.17 46.94 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.219 -0.446 . . . . 72.31 110.945 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 179' ' ' THR . . . . . 0.508 ' HA ' HD11 ' A' ' 100' ' ' LEU . 11.1 t -178.33 163.59 1.63 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.266 -0.425 . . . . 74.13 111.14 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -125.54 -72.59 0.66 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.18 -0.464 . . . . 45.33 110.871 179.89 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -60.25 -16.16 40.83 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.702 -0.761 . . . . 62.41 112.514 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 182' ' ' SER . . . . . 0.432 ' O ' ' C ' ' A' ' 183' ' ' SER . 0.3 OUTLIER -90.62 -24.38 20.54 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.909 0.385 . . . . 64.5 110.933 -179.781 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 183' ' ' SER . . . . . 0.432 ' C ' ' O ' ' A' ' 182' ' ' SER . 91.0 p 35.61 58.17 0.87 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.087 -0.506 . . . . 64.12 110.866 -179.847 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 9.1 tt -116.75 -33.5 4.79 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.09 -0.505 . . . . 74.2 110.91 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -119.38 -139.29 5.94 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.752 -0.737 . . . . 73.01 112.488 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 186' ' ' ILE . . . . . 1.042 HG21 HD21 ' A' ' 156' ' ' LEU . 8.5 mm -79.54 100.32 4.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.882 0.372 . . . . 73.22 111.162 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -48.96 119.13 2.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.136 -0.484 . . . . 71.31 110.888 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 188' ' ' PHE . . . . . 0.589 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.2 t80 -53.72 -34.36 58.6 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.172 -0.467 . . . . 75.45 110.891 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . 0.417 HD21 ' HB3' ' A' ' 111' ' ' LYS . 0.2 OUTLIER -67.16 -48.18 68.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.15 -0.477 . . . . 52.02 110.939 -179.991 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -70.12 -37.75 75.41 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.204 -0.453 . . . . 74.22 110.912 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 191' ' ' ALA . . . . . 0.58 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -72.63 -35.47 67.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.104 -0.498 . . . . 50.03 111.138 179.883 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 192' ' ' ALA . . . . . 0.715 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -60.79 -45.09 95.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.193 -0.458 . . . . 52.11 111.121 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 193' ' ' THR . . . . . 0.771 HG21 HG21 ' A' ' 211' ' ' VAL . 11.1 m -58.76 -44.99 90.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.17 -0.468 . . . . 72.43 111.12 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 6.8 t60 -73.04 -39.79 65.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.216 -0.447 . . . . 71.44 110.857 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -71.76 -48.13 48.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.178 -0.464 . . . . 71.01 111.102 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 196' ' ' LEU . . . . . 0.843 HD12 HD12 ' A' ' 113' ' ' LEU . 4.5 mm? -62.11 -37.01 83.46 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.243 -0.435 . . . . 74.51 110.917 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -60.74 -27.69 66.91 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.762 -0.733 . . . . 52.23 112.512 179.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 198' ' ' HIS . . . . . 0.406 ' CD2' HG21 ' A' ' 69' ' ' VAL . 6.5 m-70 -67.31 -35.07 78.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.752 0.31 . . . . 75.21 110.806 -179.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -68.73 -21.46 64.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.214 -0.448 . . . . 71.13 110.855 -179.774 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 200' ' ' LEU . . . . . 0.508 ' HA ' ' CD1' ' A' ' 84' ' ' TRP . 0.5 OUTLIER -88.53 2.11 53.57 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.12 -0.491 . . . . 64.13 110.91 -179.992 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 84.04 -7.67 70.03 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.731 -0.747 . . . . 50.41 112.474 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 202' ' ' MET . . . . . 0.622 ' SD ' HD12 ' A' ' 234' ' ' ILE . 98.7 mmm -53.92 167.47 0.27 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.781 0.324 . . . . 63.21 110.868 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -137.1 161.4 25.18 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.719 -0.753 . . . . 64.44 112.512 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 13.2 m-70 -57.43 143.85 38.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.824 0.345 . . . . 74.32 110.835 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -105.92 152.52 23.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 53.34 110.897 -179.835 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 206' ' ' SER . . . . . 0.447 ' HB3' ' HA2' ' A' ' 47' ' ' GLY . 1.1 m -88.07 -4.77 58.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.156 -0.474 . . . . 72.22 110.853 -179.802 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.55 138.98 83.52 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-O 121.603 0.716 . . . . 65.11 110.865 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 -7.92 22.29 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.684 2.256 . . . . 74.53 112.36 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 -125.72 28.91 6.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.234 -0.439 . . . . 63.52 110.915 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 210' ' ' ALA . . . . . 0.436 ' O ' ' HB2' ' A' ' 213' ' ' TYR . . . -87.11 145.61 26.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.151 -0.477 . . . . 62.23 111.09 179.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 211' ' ' VAL . . . . . 0.771 HG21 HG21 ' A' ' 193' ' ' THR . 0.3 OUTLIER -73.24 -26.05 22.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.459 . . . . 62.04 111.158 179.963 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 11.3 mmm -93.78 10.07 34.56 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.138 -0.483 . . . . 75.22 110.884 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 213' ' ' TYR . . . . . 0.443 ' CD1' ' HD2' ' A' ' 214' ' ' PRO . 0.5 OUTLIER -55.54 127.54 66.45 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.669 0.747 . . . . 73.43 110.918 -179.865 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 214' ' ' PRO . . . . . 0.443 ' HD2' ' CD1' ' A' ' 213' ' ' TYR . 54.0 Cg_endo -69.75 -18.47 37.03 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.634 2.222 . . . . 63.01 112.379 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 1.2 p -90.16 32.16 0.95 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.197 -0.456 . . . . 74.24 111.129 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 6.5 t80 . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.175 -0.466 . . . . 74.14 110.929 -179.928 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.074 0 CA-C-O 120.962 0.41 . . . . 65.01 110.871 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.98 -164.68 1.94 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.123 -0.49 . . . . 64.24 110.883 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 226' ' ' LEU . . . . . 0.72 HD23 ' HB3' ' A' ' 115' ' ' MET . 1.4 mm? -59.28 148.77 30.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.255 -0.43 . . . . 53.44 110.863 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 227' ' ' SER . . . . . 0.479 ' O ' HD12 ' A' ' 231' ' ' ILE . 10.5 t -86.93 163.43 17.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.184 -0.462 . . . . 74.21 110.841 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -64.88 -62.28 1.66 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.092 -0.504 . . . . 74.54 110.889 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -55.57 -28.47 55.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.179 -0.464 . . . . 72.22 110.833 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -69.22 -48.61 61.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.181 -0.463 . . . . 74.23 110.892 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 231' ' ' ILE . . . . . 0.619 HG23 ' HB3' ' A' ' 119' ' ' GLU . 7.9 mt -68.86 -41.73 82.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.165 -0.471 . . . . 73.41 111.123 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 33.7 pttt -65.65 -32.58 74.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.193 -0.458 . . . . 65.42 110.873 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -64.88 -47.22 85.34 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.773 -0.727 . . . . 63.43 112.466 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 234' ' ' ILE . . . . . 0.622 HD12 ' SD ' ' A' ' 202' ' ' MET . 8.5 tt -72.55 -30.32 33.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.792 0.329 . . . . 71.54 111.123 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -68.73 -23.81 64.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.181 -0.463 . . . . 70.33 110.896 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 236' ' ' LYS . . . . . 0.463 ' HD3' ' N ' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.31 -27.98 60.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.168 -0.469 . . . . 51.21 110.909 179.975 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 237' ' ' LEU . . . . . 0.703 HD13 ' CE ' ' A' ' 83' ' ' LYS . 9.9 tt -95.77 -31.25 13.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.199 -0.455 . . . . 75.41 110.901 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 238' ' ' TYR . . . . . . . . . . . . . 30.7 m-85 -92.02 -35.03 14.18 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.199 -0.455 . . . . 51.24 110.953 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.333 0 C-N-CA 120.781 -0.724 . . . . 32.22 112.506 179.943 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 16.2 t-105 . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.747 0.308 . . . . 71.22 110.898 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -67.16 -35.59 80.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.2 -0.454 . . . . 72.51 110.853 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.51 -37.61 88.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.183 -0.462 . . . . 61.24 110.908 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.1 -37.25 86.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.23 -0.441 . . . . 54.34 111.106 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -65.36 -42.85 92.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.219 -0.446 . . . . 73.12 110.85 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -76.55 -31.65 57.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.289 -0.414 . . . . 72.4 110.855 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -60.36 -43.65 96.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.213 -0.449 . . . . 75.11 110.934 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.617 HD22 ' CE2' ' A' ' 23' ' ' TYR . 0.8 OUTLIER -71.4 -21.24 62.02 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.15 -0.477 . . . . 72.51 110.93 179.89 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -71.55 -48.24 49.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.221 -0.445 . . . . 74.41 110.852 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.83 -28.53 69.92 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.258 -0.428 . . . . 74.05 110.883 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -62.59 -25.26 67.99 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.18 -0.464 . . . . 74.31 110.861 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.617 ' CE2' HD22 ' A' ' 19' ' ' LEU . 5.4 m-85 . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.125 -0.489 . . . . 72.55 110.937 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.503 ' O ' HD13 ' A' ' 39' ' ' LEU . 1.0 OUTLIER . . . . . 0 C--O 1.231 0.081 0 CA-C-O 120.771 0.319 . . . . 72.52 110.903 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.1 -51.67 62.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.26 -0.427 . . . . 73.13 110.841 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.74 -44.13 86.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.47 . . . . 63.32 111.165 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.99 -38.3 82.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.208 -0.451 . . . . 72.32 110.844 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.503 HD13 ' O ' ' A' ' 35' ' ' LEU . 4.6 mp -67.45 -35.49 79.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.232 -0.44 . . . . 72.11 110.956 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.46 -45.93 87.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 62.43 110.899 179.863 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.54 ' HG3' ' N ' ' A' ' 42' ' ' MET . 0.0 OUTLIER -60.34 -31.92 70.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 75.11 110.943 179.902 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.553 ' SD ' HD11 ' A' ' 19' ' ' LEU . 1.4 ttt -68.27 -34.23 75.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.098 -0.501 . . . . 63.43 110.904 179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.434 HE22 HG21 ' A' ' 58' ' ' VAL . 1.5 mm-40 -62.22 -39.48 92.95 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.242 -0.435 . . . . 74.45 110.911 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.1 mmpt? -68.59 -27.33 65.96 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.209 -0.45 . . . . 71.43 110.908 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 34.4 t80 -69.79 -45.63 67.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.225 -0.443 . . . . 73.32 110.898 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.807 ' CZ ' HD13 ' A' ' 61' ' ' ILE . 8.5 m-85 -82.83 -34.52 26.86 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.096 -0.502 . . . . 70.43 110.907 -179.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 100.13 -3.05 56.77 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.719 -0.753 . . . . 64.34 112.486 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.553 HD23 ' CB ' ' A' ' 46' ' ' PHE . 0.5 OUTLIER -59.86 142.17 88.79 Favored Pre-proline 0 C--N 1.328 -0.356 0 CA-C-O 121.616 0.722 . . . . 64.11 110.856 -179.847 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.77 -52.55 0.32 Allowed 'Trans proline' 0 C--N 1.342 0.219 0 C-N-CA 122.706 2.271 . . . . 74.5 112.314 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.607 HD12 HG23 ' A' ' 58' ' ' VAL . 0.8 OUTLIER -52.67 108.24 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.262 -0.427 . . . . 71.22 111.128 179.953 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.405 ' HA ' ' HG3' ' A' ' 43' ' ' GLN . 1.5 t -108.58 158.5 17.51 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.214 -0.448 . . . . 73.25 111.153 179.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 58.61 18.06 36.41 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.722 -0.752 . . . . 64.24 112.545 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 1.9 mmm -118.95 161.14 20.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.799 0.333 . . . . 75.23 110.902 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.418 ' HA ' ' HB ' ' A' ' 58' ' ' VAL . 53.2 tp -157.64 83.87 0.89 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.273 -0.421 . . . . 73.4 110.961 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -179.59 -31.9 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.173 -0.467 . . . . 44.35 110.859 179.951 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . 0.419 ' HB3' HD13 ' A' ' 50' ' ' ILE . 28.9 t -80.12 -101.3 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.211 -0.449 . . . . 75.25 110.832 -179.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.43 ' HB3' HD11 ' A' ' 50' ' ' ILE . 0.1 OUTLIER -84.89 -28.15 26.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 61.22 110.924 -179.992 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.607 HG23 HD12 ' A' ' 50' ' ' ILE . 90.5 t -59.52 -43.35 90.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.188 -0.46 . . . . 70.12 111.066 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.412 HG12 HD12 ' A' ' 54' ' ' LEU . 3.9 mm -75.13 -31.36 24.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.199 -0.455 . . . . 74.43 111.105 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -59.56 -44.08 93.38 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 73.45 110.923 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.807 HD13 ' CZ ' ' A' ' 46' ' ' PHE . 1.6 pp -74.57 -29.25 23.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.18 -0.464 . . . . 74.52 111.157 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -57.95 -41.25 82.42 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.194 -0.457 . . . . 74.01 110.903 179.794 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -89.33 -24.47 21.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.26 -0.427 . . . . 42.22 110.888 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 10.2 mttm -85.22 120.05 72.99 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.594 0.711 . . . . 65.34 110.894 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.73 151.63 69.25 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.686 2.258 . . . . 72.11 112.36 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.76 -64.2 0.22 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.176 -0.465 . . . . 71.51 110.825 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 13.9 p -145.04 149.6 35.39 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.237 -0.438 . . . . 55.3 110.885 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.536 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -104.72 18.26 44.21 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.733 -0.746 . . . . 64.23 112.456 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.615 HG21 ' CD2' ' A' ' 198' ' ' HIS . 0.6 OUTLIER -96.16 135.54 22.6 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.576 0.703 . . . . 74.23 111.175 179.982 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . 0.5 ' HD2' HG12 ' A' ' 69' ' ' VAL . 52.9 Cg_endo -69.87 143.06 49.1 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.677 2.251 . . . . 63.44 112.268 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -100.2 26.49 6.46 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.164 -0.471 . . . . 74.45 110.858 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 116.176 -0.466 . . . . 53.43 111.152 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.473 ' HG2' ' H ' ' A' ' 83' ' ' LYS . 53.8 Cg_endo . . . . . 0 C--O 1.231 0.145 0 CA-C-O 120.835 0.265 . . . . 71.11 112.368 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.801 ' HD2' HD22 ' A' ' 237' ' ' LEU . 4.4 mttp -45.13 141.86 2.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.199 -0.455 . . . . 64.45 110.914 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . 0.67 ' CE3' HG21 ' A' ' 89' ' ' VAL . 40.5 m0 -47.05 109.87 0.24 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.223 -0.444 . . . . 73.31 110.907 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -114.09 -6.98 13.09 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.288 -0.414 . . . . 65.3 111.146 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -58.18 168.64 0.99 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.209 -0.45 . . . . 70.34 110.883 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 18.7 mttp -73.96 -30.55 62.59 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.095 -0.502 . . . . 71.12 110.942 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -159.84 144.93 6.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.215 -0.448 . . . . 74.14 111.17 179.841 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.67 HG21 ' CE3' ' A' ' 84' ' ' TRP . 13.0 t -126.2 140.96 47.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.194 -0.457 . . . . 72.25 111.082 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 76.8 p -122.38 166.52 14.58 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.172 -0.467 . . . . 71.01 111.17 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.407 ' HB3' ' HB ' ' A' ' 134' ' ' ILE . 3.9 p90 -151.42 146.29 25.85 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.261 -0.427 . . . . 70.51 110.915 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 17.2 ttt180 -146.33 137.42 24.4 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.139 -0.482 . . . . 71.25 110.952 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.424 ' N ' HD12 ' A' ' 93' ' ' ILE . 3.5 mp -75.0 135.44 27.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.182 -0.463 . . . . 72.4 111.144 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.449 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 21.8 t -89.25 -40.63 13.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.225 -0.443 . . . . 60.2 111.114 179.846 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 1.7 t -143.74 161.83 37.59 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.197 -0.456 . . . . 64.24 110.861 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 11.8 p90 -110.19 153.25 25.03 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.129 -0.487 . . . . 72.25 110.901 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.493 ' OG1' HG21 ' A' ' 105' ' ' VAL . 0.2 OUTLIER -82.61 140.94 32.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.139 -0.482 . . . . 64.11 111.112 -179.966 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 6.5 ppt_? -73.67 -7.66 52.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.276 -0.42 . . . . 72.14 110.863 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -96.57 -25.98 15.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.194 -0.457 . . . . 74.13 110.869 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.612 HD21 ' HA ' ' A' ' 179' ' ' THR . 0.6 OUTLIER -133.64 153.73 80.32 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.599 0.714 . . . . 72.52 110.914 -179.959 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . 0.606 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.9 Cg_endo -69.69 150.91 69.24 Favored 'Trans proline' 0 C--O 1.231 0.151 0 C-N-CA 122.723 2.282 . . . . 73.11 112.318 179.902 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 16.3 t-160 -53.35 -25.57 15.73 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.233 -0.44 . . . . 74.11 110.83 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.606 HG22 ' HB2' ' A' ' 101' ' ' PRO . 13.2 tt -76.58 -38.74 31.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.231 -0.441 . . . . 74.02 111.134 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . 0.655 ' O ' HD22 ' A' ' 108' ' ' LEU . 3.1 m -69.21 -39.94 78.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.197 -0.456 . . . . 52.11 111.197 179.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.717 ' O ' HG13 ' A' ' 109' ' ' VAL . 91.6 t -72.7 -45.95 55.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 71.51 111.169 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.674 ' O ' HG22 ' A' ' 109' ' ' VAL . 4.8 t0 -63.41 -43.33 97.81 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.108 -0.496 . . . . 63.44 110.831 179.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -70.16 -33.63 72.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.139 -0.482 . . . . 75.02 110.825 -179.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.655 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -60.7 -48.72 80.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.216 -0.447 . . . . 71.04 110.937 -179.989 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.717 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.5 m -55.28 -41.58 62.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.263 -0.426 . . . . 72.31 111.132 179.836 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.461 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 42.9 t -70.13 -33.43 71.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 72.14 110.906 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.428 ' HB3' HD21 ' A' ' 189' ' ' LEU . 0.4 OUTLIER -61.93 -32.92 73.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.081 -0.509 . . . . 74.35 110.875 179.971 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.69 -40.91 8.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.239 -0.437 . . . . 74.32 111.13 179.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.76 HD12 HD12 ' A' ' 196' ' ' LEU . 0.4 OUTLIER -65.69 -34.12 77.46 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.199 -0.455 . . . . 72.0 110.971 179.944 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -69.36 -35.11 75.53 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.199 -0.455 . . . . 72.34 110.904 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . 0.4 ' O ' HD11 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -67.07 -34.98 78.84 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.181 -0.463 . . . . 54.12 110.963 179.857 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 6.8 m95 -64.47 -49.18 72.41 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.216 -0.447 . . . . 75.23 110.92 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' GLY . . . . . 0.409 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -71.84 -29.86 66.7 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.703 -0.761 . . . . 73.32 112.479 -179.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.2 mtmt -61.36 -17.71 55.24 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.817 0.342 . . . . 72.42 110.923 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.797 ' HB3' HG23 ' A' ' 231' ' ' ILE . 18.7 mm-40 -97.96 13.26 31.4 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.124 -0.489 . . . . 75.24 110.901 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 0.903 HD12 HD12 ' A' ' 122' ' ' LEU . 3.3 pt -148.28 144.96 19.37 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.631 0.729 . . . . 71.34 111.096 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.69 28.17 0.18 Allowed 'Trans proline' 0 C--O 1.232 0.206 0 C-N-CA 122.72 2.28 . . . . 72.21 112.316 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.903 HD12 HD12 ' A' ' 120' ' ' ILE . 10.3 mt -76.83 -160.25 0.15 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.275 -0.42 . . . . 73.22 110.911 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -153.49 120.95 5.88 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.165 -0.47 . . . . 74.12 110.831 179.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 9.3 m-30 -110.31 142.74 41.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.189 -0.46 . . . . 75.54 110.838 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -123.84 141.23 52.22 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.123 -0.49 . . . . 75.14 110.857 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.14 157.79 25.19 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.188 -0.46 . . . . 72.22 110.894 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . 0.857 HG11 ' HB2' ' A' ' 132' ' ' ALA . 25.2 m -103.15 126.32 57.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.208 -0.451 . . . . 50.13 111.149 179.816 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.599 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -145.82 -10.77 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.227 -0.442 . . . . 74.43 111.164 179.878 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' TRP . . . . . 0.599 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -156.57 109.18 2.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.177 -0.465 . . . . 71.25 110.888 179.991 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 105.28 -163.34 14.24 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.754 -0.736 . . . . 62.11 112.471 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -101.88 156.42 17.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.792 0.329 . . . . 63.25 111.101 -179.836 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . 0.857 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -111.41 165.27 12.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.16 -0.473 . . . . 51.34 111.127 179.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -76.74 -53.69 7.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.269 -0.423 . . . . 75.41 110.918 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . 0.644 HD12 ' N ' ' A' ' 134' ' ' ILE . 1.9 mp -89.92 107.76 18.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.21 -0.45 . . . . 70.51 111.085 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . 0.449 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 22.0 mmm -95.79 130.94 42.57 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.15 -0.477 . . . . 72.43 110.878 179.814 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.533 ' CD1' HG22 ' A' ' 134' ' ' ILE . 0.3 OUTLIER -111.22 90.29 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.186 -0.461 . . . . 70.04 111.113 179.964 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . 0.415 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -130.02 167.46 21.72 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.769 -0.729 . . . . 63.34 112.522 179.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' PHE . . . . . 0.448 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 46.8 m-85 -105.49 150.88 24.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.9 0.381 . . . . 74.01 110.908 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.574 ' HB1' ' CB ' ' A' ' 143' ' ' HIS . . . 177.01 167.42 0.54 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.179 -0.464 . . . . 71.21 111.13 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 6.7 mtp180 -103.94 173.09 6.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.172 -0.467 . . . . 62.21 110.913 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -57.91 -15.55 20.89 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.73 -0.747 . . . . 74.24 112.506 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -98.74 13.32 32.68 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.831 0.348 . . . . 75.03 111.104 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' HIS . . . . . 0.574 ' CB ' ' HB1' ' A' ' 139' ' ' ALA . 6.2 p80 -71.48 -9.36 58.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.242 -0.435 . . . . 71.11 110.871 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 118.99 49.84 0.32 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.748 -0.739 . . . . 45.51 112.461 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -170.23 -176.78 2.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.767 0.318 . . . . 72.14 110.877 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -76.19 -179.74 5.21 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.259 -0.428 . . . . 51.25 110.903 -179.787 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 147' ' ' TYR . . . . . 0.43 ' HA ' ' HD2' ' A' ' 148' ' ' PRO . 0.2 OUTLIER 65.01 107.31 0.03 OUTLIER Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 121.656 0.741 . . . . 73.4 110.863 -179.922 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 148' ' ' PRO . . . . . 0.43 ' HD2' ' HA ' ' A' ' 147' ' ' TYR . 53.8 Cg_endo -69.76 151.9 69.19 Favored 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.689 2.259 . . . . 74.53 112.334 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 149' ' ' PHE . . . . . 0.419 ' O ' ' CG ' ' A' ' 150' ' ' ASP . 0.4 OUTLIER -53.43 -25.51 16.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.242 -0.435 . . . . 63.52 110.89 179.98 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . 0.419 ' CG ' ' O ' ' A' ' 149' ' ' PHE . 2.0 p30 45.38 24.44 0.16 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.151 -0.477 . . . . 63.11 110.821 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 42.62 -160.52 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.743 -0.741 . . . . 71.41 112.511 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 144.55 54.38 Favored 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.701 2.267 . . . . 75.11 112.312 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . 0.457 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 105.97 -133.87 11.82 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.673 -0.775 . . . . 70.32 112.471 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 154' ' ' ASN . . . . . 0.457 ' C ' ' O ' ' A' ' 153' ' ' GLY . 3.3 p30 -33.67 136.64 0.11 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.906 0.384 . . . . 73.25 110.883 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 155' ' ' THR . . . . . 0.497 HG23 ' HA2' ' A' ' 68' ' ' GLY . 0.3 OUTLIER 75.35 107.77 0.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.124 -0.489 . . . . 44.41 111.132 -179.997 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 156' ' ' LEU . . . . . 1.043 HD21 HG21 ' A' ' 186' ' ' ILE . 0.7 OUTLIER -91.86 -55.21 3.55 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.258 -0.428 . . . . 75.02 110.949 179.924 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . 0.562 ' HB1' ' O ' ' A' ' 171' ' ' HIS . . . -158.76 148.88 19.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.198 -0.456 . . . . 71.42 111.136 179.758 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 26.1 p-80 -110.41 122.59 48.07 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.262 -0.426 . . . . 72.02 110.88 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . 0.486 ' H ' HG22 ' A' ' 69' ' ' VAL . . . -110.52 161.1 16.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.231 -0.441 . . . . 74.42 111.075 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 18.9 m-30 -112.3 134.72 53.68 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.254 -0.43 . . . . 75.31 110.897 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 161' ' ' ALA . . . . . 0.639 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -63.97 162.73 27.81 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.53 0.681 . . . . 61.04 111.091 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 162' ' ' PRO . . . . . 0.639 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 54.4 Cg_endo -69.73 71.59 1.49 Allowed 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.687 2.258 . . . . 74.44 112.366 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -136.08 110.1 0.78 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.776 -0.726 . . . . 61.41 112.537 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 67.1 165.93 0.22 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.89 0.376 . . . . 73.1 111.1 -179.839 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -54.72 -35.7 58.17 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.701 -0.762 . . . . 74.03 112.489 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.84 -19.53 63.46 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.896 0.379 . . . . 65.12 110.938 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -88.47 167.0 35.06 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.718 -0.753 . . . . 43.43 112.479 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 168' ' ' GLY . . . . . 0.427 ' O ' HG13 ' A' ' 134' ' ' ILE . . . 80.47 -1.95 79.91 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.81 -0.71 . . . . 74.31 112.482 -179.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -70.57 148.3 48.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.846 0.355 . . . . 63.41 110.835 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.3 130.16 56.04 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.215 -0.448 . . . . 74.21 111.047 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 171' ' ' HIS . . . . . 0.562 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 26.5 m170 -129.69 132.18 46.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.224 -0.444 . . . . 72.53 110.885 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -114.23 138.94 49.83 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.235 -0.439 . . . . 71.44 110.849 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 57.8 t0 -70.63 97.82 1.4 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.157 -0.474 . . . . 74.11 110.877 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.92 -16.69 7.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.222 -0.445 . . . . 72.25 110.933 -179.904 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -78.39 -16.16 57.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.168 -0.469 . . . . 73.32 110.851 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -84.94 -173.54 4.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.21 -0.45 . . . . 63.2 110.885 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 45.6 mtt85 -111.75 109.73 19.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.142 -0.481 . . . . 63.14 110.872 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 70.7 m95 -109.75 138.27 46.36 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.199 -0.455 . . . . 72.31 110.884 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 179' ' ' THR . . . . . 0.612 ' HA ' HD21 ' A' ' 100' ' ' LEU . 11.4 t -177.76 163.54 1.86 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.279 -0.419 . . . . 74.13 111.165 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -127.29 -72.04 0.65 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.204 -0.453 . . . . 45.33 110.826 179.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -58.67 -16.94 32.21 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.668 -0.777 . . . . 62.41 112.5 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 182' ' ' SER . . . . . 0.411 ' O ' ' C ' ' A' ' 183' ' ' SER . 1.2 m -92.56 -24.32 18.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.853 0.359 . . . . 64.5 110.846 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 183' ' ' SER . . . . . 0.411 ' C ' ' O ' ' A' ' 182' ' ' SER . 4.5 p 37.36 51.82 1.18 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.187 -0.46 . . . . 64.12 110.832 -179.802 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 41.8 tp -109.18 -33.44 6.87 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.112 -0.495 . . . . 74.2 110.947 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -118.74 -138.51 5.87 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.686 -0.769 . . . . 73.01 112.401 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 186' ' ' ILE . . . . . 1.043 HG21 HD21 ' A' ' 156' ' ' LEU . 8.2 mm -79.39 101.76 4.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.908 0.385 . . . . 73.22 111.165 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -49.38 119.18 3.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.162 -0.472 . . . . 71.31 110.895 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 188' ' ' PHE . . . . . 0.586 ' HD2' ' HB3' ' A' ' 108' ' ' LEU . 1.0 OUTLIER -53.99 -33.03 55.92 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.194 -0.457 . . . . 75.45 110.87 -179.99 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . 0.428 HD21 ' HB3' ' A' ' 111' ' ' LYS . 0.2 OUTLIER -67.24 -48.25 68.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.11 -0.495 . . . . 52.02 110.913 -179.945 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 23.0 t80 -70.4 -37.01 74.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.234 -0.439 . . . . 74.22 110.891 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 191' ' ' ALA . . . . . 0.473 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -72.65 -36.9 68.07 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.148 -0.478 . . . . 50.03 111.107 179.878 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 192' ' ' ALA . . . . . 0.704 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -57.9 -45.08 87.02 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.209 -0.45 . . . . 52.11 111.159 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 193' ' ' THR . . . . . 0.415 HG21 HG21 ' A' ' 211' ' ' VAL . 0.2 OUTLIER -59.58 -43.13 93.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.193 -0.458 . . . . 72.43 111.177 -179.975 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 4.9 t60 -72.59 -38.23 67.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.3 -0.409 . . . . 71.44 110.902 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -75.17 -47.36 28.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.235 -0.439 . . . . 71.01 111.108 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 196' ' ' LEU . . . . . 0.76 HD12 HD12 ' A' ' 113' ' ' LEU . 4.5 mm? -64.6 -43.72 92.87 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.27 -0.423 . . . . 74.51 110.908 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -57.4 -27.98 58.75 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.679 -0.772 . . . . 52.23 112.485 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 198' ' ' HIS . . . . . 0.615 ' CD2' HG21 ' A' ' 69' ' ' VAL . 4.8 m-70 -66.79 -43.88 82.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.764 0.316 . . . . 75.21 110.818 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.21 -21.83 64.2 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 71.13 110.837 -179.8 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 200' ' ' LEU . . . . . 0.433 ' O ' ' HA ' ' A' ' 83' ' ' LYS . 4.3 mt -84.68 -0.93 55.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.142 -0.481 . . . . 64.13 110.97 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 83.48 -3.97 83.23 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.721 -0.752 . . . . 50.41 112.501 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 202' ' ' MET . . . . . 0.59 ' SD ' HD12 ' A' ' 234' ' ' ILE . 99.6 mmm -51.79 172.79 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.855 0.359 . . . . 63.21 110.853 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -132.73 160.17 23.71 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.746 -0.74 . . . . 64.44 112.433 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 22.6 m-70 -61.53 161.73 9.21 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.786 0.327 . . . . 74.32 110.852 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -125.05 147.49 48.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.213 -0.448 . . . . 53.34 110.846 -179.786 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 8.3 p -87.92 -3.93 58.88 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.153 -0.476 . . . . 72.22 110.877 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -70.93 137.77 85.11 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.659 0.742 . . . . 65.11 110.823 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -69.85 -6.23 18.14 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.693 2.262 . . . . 74.53 112.277 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -130.9 29.26 4.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.279 -0.419 . . . . 63.52 110.842 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 210' ' ' ALA . . . . . 0.45 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.43 145.65 26.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.277 -0.42 . . . . 62.23 111.134 179.912 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 211' ' ' VAL . . . . . 0.415 HG21 HG21 ' A' ' 193' ' ' THR . 0.4 OUTLIER -66.91 -27.6 40.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.247 -0.433 . . . . 62.04 111.157 179.986 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 7.4 tpp -96.33 7.98 45.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.185 -0.461 . . . . 75.22 110.844 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 213' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -55.5 110.29 2.15 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.651 0.738 . . . . 73.43 110.962 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.69 -18.54 37.26 Favored 'Trans proline' 0 C--O 1.231 0.158 0 C-N-CA 122.747 2.298 . . . . 63.01 112.356 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 215' ' ' THR . . . . . 0.454 HG23 ' CG2' ' A' ' 61' ' ' ILE . 0.2 OUTLIER -84.24 55.71 3.45 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.224 -0.444 . . . . 74.24 111.152 -179.968 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 6.0 t80 . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 74.14 110.936 -179.895 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 224' ' ' PHE . . . . . 0.4 ' HZ ' ' HG1' ' A' ' 193' ' ' THR . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.934 0.397 . . . . 65.01 110.927 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -143.65 167.14 22.96 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.125 -0.489 . . . . 64.24 110.913 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 226' ' ' LEU . . . . . 0.699 HD13 ' HG3' ' A' ' 119' ' ' GLU . 0.4 OUTLIER -59.79 149.52 30.87 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.223 -0.444 . . . . 53.44 110.96 179.88 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 227' ' ' SER . . . . . 0.464 ' O ' HD12 ' A' ' 231' ' ' ILE . 5.9 t -86.88 158.6 19.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.236 -0.438 . . . . 74.21 110.85 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -65.4 -65.1 0.72 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.129 -0.487 . . . . 74.54 110.933 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -55.42 -26.34 41.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.196 -0.456 . . . . 72.22 110.822 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 230' ' ' ASP . . . . . 0.424 ' HB2' ' HB3' ' A' ' 227' ' ' SER . 33.1 t70 -69.34 -48.4 61.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.231 -0.44 . . . . 74.23 110.872 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 231' ' ' ILE . . . . . 0.797 HG23 ' HB3' ' A' ' 119' ' ' GLU . 8.7 mt -68.49 -42.94 84.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.193 -0.458 . . . . 73.41 111.118 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 7.4 pttt -63.86 -32.38 73.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.137 -0.483 . . . . 65.42 110.85 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -62.95 -49.76 69.51 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.708 -0.758 . . . . 63.43 112.446 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 234' ' ' ILE . . . . . 0.59 HD12 ' SD ' ' A' ' 202' ' ' MET . 9.1 tt -72.97 -31.99 37.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.831 0.348 . . . . 71.54 111.187 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 11.5 mt-30 -70.9 -23.64 62.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.142 -0.481 . . . . 70.33 110.882 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 236' ' ' LYS . . . . . 0.422 ' HE2' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -73.77 -28.46 61.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.175 -0.466 . . . . 51.21 110.865 179.963 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 237' ' ' LEU . . . . . 0.801 HD22 ' HD2' ' A' ' 83' ' ' LYS . 8.4 tt -97.98 -26.5 14.62 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.263 -0.426 . . . . 75.41 110.935 179.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 238' ' ' TYR . . . . . 0.446 ' CE1' HD11 ' A' ' 122' ' ' LEU . 15.1 m-85 -92.3 -35.28 13.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.465 . . . . 51.24 110.918 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.234 0 C-N-CA 120.708 -0.758 . . . . 32.22 112.481 179.961 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 22.1 t-105 . . . . . 0 C--O 1.23 0.071 0 CA-C-O 120.746 0.308 . . . . 71.22 110.912 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 71.6 tt0 -73.12 -36.95 66.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.264 -0.425 . . . . 72.51 110.932 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -65.0 -38.42 90.9 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 61.24 110.909 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.27 -39.05 74.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.13 -0.486 . . . . 54.34 111.116 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.421 HE22 HD22 ' A' ' 35' ' ' LEU . 3.3 mt-30 -69.74 -43.0 73.21 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.174 -0.466 . . . . 73.12 110.905 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -66.42 -31.36 72.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.2 -0.454 . . . . 72.4 110.846 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -61.22 -36.27 79.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.168 -0.469 . . . . 75.11 110.934 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.721 HD12 ' HG2' ' A' ' 38' ' ' LYS . 3.1 tm? -71.88 -21.02 61.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.06 -0.518 . . . . 72.51 110.868 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 4.2 ptmt -75.06 -28.84 60.52 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.235 -0.438 . . . . 74.41 110.841 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.7 ptp180 -86.35 -28.11 23.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.295 -0.412 . . . . 74.05 110.851 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -65.05 -18.15 65.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.18 -0.464 . . . . 74.31 110.895 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.601 ' HB3' HG21 ' A' ' 72' ' ' VAL . 7.6 m-85 . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.169 -0.469 . . . . 72.55 110.869 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.456 ' C ' HD12 ' A' ' 35' ' ' LEU . 2.1 pp . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.792 0.329 . . . . 72.52 110.964 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.87 -53.13 61.64 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.198 -0.455 . . . . 73.13 110.981 179.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -66.05 -36.89 84.44 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.091 -0.504 . . . . 63.32 111.062 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.721 ' HG2' HD12 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -65.34 -49.34 69.76 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.262 -0.426 . . . . 72.32 110.849 -179.969 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.981 HD11 HD22 ' A' ' 54' ' ' LEU . 4.4 mt -63.64 -35.37 80.31 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.23 -0.441 . . . . 72.11 110.925 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 12.7 tmtt? -59.89 -45.83 91.27 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.19 -0.459 . . . . 62.43 110.877 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 3.2 pt-20 -60.91 -32.77 72.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.191 -0.459 . . . . 75.11 110.913 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 27.0 ttp -68.34 -34.1 75.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 63.43 110.954 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.455 ' CD ' HD11 ' A' ' 48' ' ' LEU . 1.8 mm-40 -59.79 -39.59 85.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 74.45 110.878 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.6 mmpt? -70.56 -30.61 67.38 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.242 -0.436 . . . . 71.43 110.815 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 14.5 t80 -70.4 -42.22 71.95 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.255 -0.43 . . . . 73.32 110.893 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.823 ' CZ ' HD13 ' A' ' 61' ' ' ILE . 7.9 m-85 -82.19 -35.19 28.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.137 -0.483 . . . . 70.43 110.881 -179.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.431 ' HA3' ' HB3' ' A' ' 206' ' ' SER . . . 102.45 -7.81 54.32 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.777 -0.725 . . . . 64.34 112.479 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.529 HD23 ' CB ' ' A' ' 46' ' ' PHE . 0.7 OUTLIER -60.07 138.34 91.13 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-O 121.649 0.737 . . . . 64.11 110.869 -179.941 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.82 -52.12 0.34 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.677 2.252 . . . . 74.5 112.329 179.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.507 HD12 HG23 ' A' ' 58' ' ' VAL . 0.8 OUTLIER -52.08 108.26 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.202 -0.454 . . . . 71.22 111.161 179.914 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.409 ' HA ' ' HG3' ' A' ' 43' ' ' GLN . 6.8 p -101.86 159.09 15.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.135 -0.484 . . . . 73.25 111.166 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 58.44 18.63 37.54 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.734 -0.746 . . . . 64.24 112.484 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 27.8 mmt -103.98 160.98 14.37 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.803 0.335 . . . . 75.23 110.899 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.981 HD22 HD11 ' A' ' 39' ' ' LEU . 25.8 tp -173.69 86.17 0.05 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.271 -0.422 . . . . 73.4 110.952 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.0 p30 174.72 -28.3 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.141 -0.481 . . . . 44.35 110.862 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 25.5 m -94.44 -100.19 0.15 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.244 -0.435 . . . . 75.25 110.844 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.573 ' O ' HG23 ' A' ' 61' ' ' ILE . 3.3 tpp85 -84.79 -29.06 25.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.122 -0.49 . . . . 61.22 110.887 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.507 HG23 HD12 ' A' ' 50' ' ' ILE . 61.5 t -65.72 -41.03 89.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.153 -0.476 . . . . 70.12 111.092 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.415 HD13 ' HA ' ' A' ' 59' ' ' ILE . 1.0 OUTLIER -75.16 -31.61 24.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.244 -0.435 . . . . 74.43 111.195 179.899 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -59.52 -44.23 93.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 73.45 110.86 179.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.823 HD13 ' CZ ' ' A' ' 46' ' ' PHE . 1.3 pp -62.92 -29.03 46.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.149 -0.478 . . . . 74.52 111.12 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . 0.44 ' N ' HG13 ' A' ' 61' ' ' ILE . 3.6 mmt -69.01 -35.03 76.2 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.215 -0.448 . . . . 74.01 110.852 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -88.56 -26.31 22.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.207 -0.452 . . . . 42.22 110.874 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.3 136.27 38.0 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.556 0.693 . . . . 65.34 110.891 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . 0.474 ' HB2' HD22 ' A' ' 156' ' ' LEU . 53.9 Cg_endo -69.74 127.62 14.88 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.621 2.214 . . . . 72.11 112.401 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 5.5 ttm180 -115.02 -88.05 0.58 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.271 -0.422 . . . . 71.51 110.864 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -146.02 156.39 43.45 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.17 -0.468 . . . . 55.3 110.935 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.508 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -98.22 21.05 48.02 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.796 -0.716 . . . . 64.23 112.462 -179.822 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.568 HG21 ' CD2' ' A' ' 198' ' ' HIS . 0.2 OUTLIER -109.79 135.32 20.44 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.627 0.727 . . . . 74.23 111.193 -179.994 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . 0.524 ' HD2' HG12 ' A' ' 69' ' ' VAL . 54.7 Cg_endo -69.78 156.24 63.8 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.715 2.277 . . . . 63.44 112.381 179.964 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -105.84 6.28 31.46 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.26 -0.427 . . . . 74.45 110.867 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.601 HG21 ' HB3' ' A' ' 23' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.263 0 CA-C-N 116.197 -0.456 . . . . 53.43 111.053 -179.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo . . . . . 0 C--O 1.232 0.191 0 CA-C-O 120.832 0.263 . . . . 71.11 112.351 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.647 ' HD2' HD22 ' A' ' 237' ' ' LEU . 26.2 mttp -92.68 165.47 12.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.229 -0.442 . . . . 64.45 110.891 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . 0.431 ' CD1' ' HA ' ' A' ' 200' ' ' LEU . 54.5 m95 -48.66 127.7 14.0 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.191 -0.459 . . . . 73.31 110.981 179.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 15.1 t -115.23 -1.37 12.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.301 -0.409 . . . . 65.3 111.218 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 3.6 m -68.15 -175.94 0.66 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.18 -0.464 . . . . 70.34 110.829 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 2.8 mttt -92.8 -25.03 18.33 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.099 -0.501 . . . . 71.12 110.904 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.43 HG23 ' CD2' ' A' ' 123' ' ' HIS . 0.3 OUTLIER -153.83 142.13 13.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.206 -0.452 . . . . 74.14 111.138 179.91 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 58.8 t -116.6 130.22 71.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 72.25 111.167 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.671 HG22 ' HB3' ' A' ' 125' ' ' ARG . 11.7 p -120.01 168.07 11.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.207 -0.452 . . . . 71.01 111.109 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 2.9 p90 -145.38 146.93 31.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.217 -0.447 . . . . 70.51 110.933 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.431 ' CB ' ' HB3' ' A' ' 132' ' ' ALA . 0.5 OUTLIER -146.21 131.67 18.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.104 -0.498 . . . . 71.25 110.914 179.962 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.452 HD13 ' HB ' ' A' ' 136' ' ' ILE . 18.6 mm -74.99 127.2 36.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.138 -0.483 . . . . 72.4 111.096 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.565 HG22 ' SD ' ' A' ' 135' ' ' MET . 6.5 t -86.38 -40.8 14.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.184 -0.462 . . . . 60.2 111.1 179.826 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 32.9 t -157.16 169.52 24.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.449 . . . . 64.24 110.852 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 11.9 p90 -127.45 155.09 44.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.143 -0.481 . . . . 72.25 110.973 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 3.9 t -95.03 141.26 28.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.116 -0.493 . . . . 64.11 111.16 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 3.6 ptm180 -52.62 -18.96 2.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.287 -0.415 . . . . 72.14 110.836 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.31 -37.75 88.07 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.252 -0.431 . . . . 74.13 110.778 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.757 HD22 HG21 ' A' ' 104' ' ' THR . 1.3 mt -138.65 152.94 71.84 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.613 0.72 . . . . 72.52 110.925 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . 0.579 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.6 Cg_endo -69.69 151.12 69.41 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.788 2.325 . . . . 73.11 112.354 179.817 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 13.1 t-160 -51.27 -26.28 7.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.253 -0.43 . . . . 74.11 110.875 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.579 HG22 ' HB2' ' A' ' 101' ' ' PRO . 12.2 tt -77.53 -38.06 25.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.175 -0.466 . . . . 74.02 111.084 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . 0.757 HG21 HD22 ' A' ' 100' ' ' LEU . 3.0 m -69.01 -40.33 78.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.202 -0.454 . . . . 52.11 111.131 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.76 ' O ' HG13 ' A' ' 109' ' ' VAL . 93.5 t -72.16 -46.19 59.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.266 -0.424 . . . . 71.51 111.097 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.662 ' O ' HG22 ' A' ' 109' ' ' VAL . 45.6 t0 -59.35 -45.69 90.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.202 -0.453 . . . . 63.44 110.842 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -70.36 -33.53 71.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.186 -0.461 . . . . 75.02 110.815 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.622 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -60.3 -49.09 78.99 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.246 -0.434 . . . . 71.04 110.888 -179.958 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.76 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.5 m -55.62 -41.49 64.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.153 -0.476 . . . . 72.31 111.045 179.892 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.465 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 37.5 t -70.0 -33.76 72.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.183 -0.462 . . . . 72.14 110.819 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.429 ' CG ' HD21 ' A' ' 189' ' ' LEU . 0.3 OUTLIER -61.92 -33.3 73.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.152 -0.476 . . . . 74.35 110.864 179.954 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -95.87 -40.28 9.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.225 -0.443 . . . . 74.32 111.092 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.696 ' CD1' HD12 ' A' ' 196' ' ' LEU . 0.4 OUTLIER -65.24 -32.9 74.81 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.205 -0.452 . . . . 72.0 110.92 -179.954 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 38.9 t30 -64.66 -35.51 81.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 72.34 110.846 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . 0.542 ' O ' HD11 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -67.49 -33.79 75.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.174 -0.466 . . . . 54.12 110.862 179.932 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 9.4 m95 -70.58 -52.47 21.36 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.186 -0.461 . . . . 75.23 110.904 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -60.24 -43.61 98.31 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.724 -0.751 . . . . 73.32 112.494 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.97 -19.06 60.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.714 0.292 . . . . 72.42 110.85 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.73 ' HG2' HD13 ' A' ' 226' ' ' LEU . 0.2 OUTLIER -96.29 13.4 27.72 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.235 -0.438 . . . . 75.24 110.886 179.952 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 1.043 HD12 HD12 ' A' ' 122' ' ' LEU . 8.6 pt -146.89 147.04 28.32 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.55 0.691 . . . . 71.34 111.2 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 5.72 1.59 Allowed 'Trans proline' 0 C--O 1.233 0.245 0 C-N-CA 122.655 2.236 . . . . 72.21 112.32 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 1.043 HD12 HD12 ' A' ' 120' ' ' ILE . 10.9 mt -61.12 -160.96 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.2 -0.454 . . . . 73.22 110.894 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.43 ' CD2' HG23 ' A' ' 88' ' ' VAL . 3.5 t-160 -150.67 123.18 8.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.228 -0.442 . . . . 74.12 110.803 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 11.1 m-30 -107.54 148.76 28.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.253 -0.43 . . . . 75.54 110.934 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.671 ' HB3' HG22 ' A' ' 90' ' ' THR . 0.0 OUTLIER -133.03 141.24 48.14 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.153 -0.476 . . . . 75.14 110.843 -179.884 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.8 139.71 35.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 72.22 110.841 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . 0.92 HG11 ' HB2' ' A' ' 132' ' ' ALA . 19.1 m -102.91 133.43 46.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.228 -0.442 . . . . 50.13 111.046 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.446 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -146.68 -23.59 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.157 -0.474 . . . . 74.43 111.064 179.936 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' TRP . . . . . 0.446 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -138.59 109.3 6.64 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.195 -0.457 . . . . 71.25 110.961 179.924 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 108.48 -159.37 14.27 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.727 -0.749 . . . . 62.11 112.496 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.75 155.4 18.15 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.734 0.302 . . . . 63.25 111.158 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . 0.92 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -112.87 165.33 12.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.225 -0.443 . . . . 51.34 111.104 179.851 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -65.37 -60.31 3.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.25 -0.432 . . . . 75.41 110.85 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 19.3 mt -90.7 129.42 41.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.161 -0.472 . . . . 70.51 111.124 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . 0.565 ' SD ' HG22 ' A' ' 94' ' ' VAL . 0.0 OUTLIER -107.85 122.97 47.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.136 -0.483 . . . . 72.43 110.869 179.882 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.452 ' HB ' HD13 ' A' ' 93' ' ' ILE . 0.8 OUTLIER -105.64 95.73 4.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.239 -0.437 . . . . 70.04 111.132 179.944 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . 0.4 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -130.96 166.62 22.6 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.73 -0.747 . . . . 63.34 112.542 179.851 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' PHE . . . . . 0.499 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 60.3 m-85 -105.28 149.14 26.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.912 0.387 . . . . 74.01 110.848 -179.859 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.617 ' HB1' ' CB ' ' A' ' 143' ' ' HIS . . . 173.89 167.23 0.2 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.116 -0.493 . . . . 71.21 111.105 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 33.3 mtt180 -104.19 173.39 6.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.217 -0.447 . . . . 62.21 110.871 -179.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -57.46 -15.3 16.41 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.681 -0.771 . . . . 74.24 112.475 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -100.91 14.17 32.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.85 0.357 . . . . 75.03 111.09 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' HIS . . . . . 0.617 ' CB ' ' HB1' ' A' ' 139' ' ' ALA . 8.9 p80 -68.19 -33.35 74.28 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.249 -0.432 . . . . 71.11 110.881 179.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 147.28 47.13 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.765 -0.731 . . . . 45.51 112.491 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -158.82 149.57 20.04 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.763 0.316 . . . . 72.14 110.857 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 146' ' ' SER . . . . . 0.475 ' O ' ' CB ' ' A' ' 147' ' ' TYR . 49.0 p -63.73 99.12 0.21 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.224 -0.444 . . . . 51.25 110.888 -179.777 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 147' ' ' TYR . . . . . 0.475 ' CB ' ' O ' ' A' ' 146' ' ' SER . 0.2 OUTLIER 163.04 121.21 0.0 OUTLIER Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.704 0.764 . . . . 73.4 110.848 -179.874 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.74 138.47 37.95 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.705 2.27 . . . . 74.53 112.372 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 149' ' ' PHE . . . . . 0.44 ' C ' ' H ' ' A' ' 151' ' ' GLY . 7.6 p90 -53.84 -42.38 68.44 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.209 -0.451 . . . . 63.52 110.841 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 75.61 -21.93 0.29 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.184 -0.462 . . . . 63.11 110.927 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . 0.44 ' H ' ' C ' ' A' ' 149' ' ' PHE . . . 78.83 -159.49 45.89 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.678 -0.773 . . . . 71.41 112.515 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.67 142.41 48.26 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.711 2.274 . . . . 75.11 112.363 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . 0.437 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 104.34 -137.52 13.62 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.752 -0.737 . . . . 70.32 112.522 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 154' ' ' ASN . . . . . 0.437 ' C ' ' O ' ' A' ' 153' ' ' GLY . 3.4 p30 -34.86 141.32 0.06 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.944 0.402 . . . . 73.25 110.826 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 155' ' ' THR . . . . . 0.5 HG23 ' HA2' ' A' ' 68' ' ' GLY . 0.2 OUTLIER 75.22 90.07 0.08 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.15 -0.477 . . . . 44.41 111.16 -179.964 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 156' ' ' LEU . . . . . 0.737 HD21 ' CG2' ' A' ' 186' ' ' ILE . 0.0 OUTLIER -71.9 -59.35 2.79 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.162 -0.472 . . . . 75.02 110.914 179.953 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . 0.508 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -161.59 148.82 14.57 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.198 -0.455 . . . . 71.42 111.088 179.779 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 158' ' ' HIS . . . . . 0.403 ' O ' ' HB2' ' A' ' 171' ' ' HIS . 15.4 p-80 -103.47 124.38 48.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.194 -0.457 . . . . 72.02 110.862 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . 0.466 ' H ' HG22 ' A' ' 69' ' ' VAL . . . -110.58 159.41 17.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.225 -0.443 . . . . 74.42 111.083 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 14.2 m-85 -112.58 152.24 29.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.217 -0.447 . . . . 75.31 110.88 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 161' ' ' ALA . . . . . 0.68 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -81.67 163.64 53.01 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.591 0.71 . . . . 61.04 111.113 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 162' ' ' PRO . . . . . 0.68 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.6 Cg_endo -69.81 79.28 0.97 Allowed 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.667 2.245 . . . . 74.44 112.354 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -148.87 122.8 1.53 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.752 -0.737 . . . . 61.41 112.504 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 1.1 m 66.43 149.75 0.05 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.803 0.335 . . . . 73.1 111.138 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -52.76 -45.45 60.65 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.687 -0.768 . . . . 74.03 112.474 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 166' ' ' LEU . . . . . 0.457 ' C ' HD23 ' A' ' 166' ' ' LEU . 10.1 tt -64.25 -39.9 94.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.891 0.377 . . . . 65.12 110.993 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -78.79 170.49 54.77 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.788 -0.72 . . . . 43.43 112.439 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 80.46 22.86 61.62 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.765 -0.731 . . . . 74.31 112.457 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 85.5 m-20 -96.32 165.13 12.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.853 0.359 . . . . 63.41 110.886 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.44 130.9 55.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.196 -0.456 . . . . 74.21 111.08 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 171' ' ' HIS . . . . . 0.403 ' HB2' ' O ' ' A' ' 158' ' ' HIS . 25.0 m170 -125.05 158.74 33.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.224 -0.444 . . . . 72.53 110.861 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -140.87 137.73 33.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.252 -0.431 . . . . 71.44 110.884 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 173' ' ' ASP . . . . . 0.421 ' HB3' ' OE1' ' A' ' 176' ' ' GLU . 13.6 t0 -70.85 100.92 2.02 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.133 -0.485 . . . . 74.11 110.861 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.05 -11.45 39.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.173 -0.467 . . . . 72.25 110.903 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -78.79 -16.53 57.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.143 -0.48 . . . . 73.32 110.85 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 176' ' ' GLU . . . . . 0.437 ' CD ' HD13 ' A' ' 156' ' ' LEU . 1.4 mt-10 -90.53 -168.83 2.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.253 -0.431 . . . . 63.2 110.893 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 54.1 mtt85 -115.64 121.49 42.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.162 -0.472 . . . . 63.14 110.869 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 60.4 m95 -116.92 144.42 44.56 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.213 -0.449 . . . . 72.31 110.916 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 179' ' ' THR . . . . . 0.609 ' HA ' HD21 ' A' ' 100' ' ' LEU . 2.5 t -177.0 163.81 2.21 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.224 -0.444 . . . . 74.13 111.139 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -125.07 -70.0 0.77 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.194 -0.457 . . . . 45.33 110.845 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -67.74 -10.8 59.09 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.68 -0.772 . . . . 62.41 112.529 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 182' ' ' SER . . . . . 0.518 ' HB3' HG21 ' A' ' 179' ' ' THR . 0.3 OUTLIER -95.07 -24.54 16.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.914 0.388 . . . . 64.5 110.881 -179.723 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 183' ' ' SER . . . . . 0.464 ' C ' ' O ' ' A' ' 182' ' ' SER . 56.8 m 32.94 66.17 0.21 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.076 -0.511 . . . . 64.12 110.898 -179.79 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 6.4 tp -116.9 -33.61 4.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.162 -0.472 . . . . 74.2 110.885 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -128.91 -128.26 3.04 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.756 -0.735 . . . . 73.01 112.506 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 186' ' ' ILE . . . . . 0.737 ' CG2' HD21 ' A' ' 156' ' ' LEU . 4.6 mm -79.33 97.56 2.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.856 0.36 . . . . 73.22 111.178 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -54.75 121.17 7.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.177 -0.465 . . . . 71.31 110.91 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 188' ' ' PHE . . . . . 0.639 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.3 t80 -54.43 -33.16 58.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.145 -0.479 . . . . 75.45 110.867 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . 0.644 HD12 ' CD2' ' A' ' 224' ' ' PHE . 0.1 OUTLIER -67.15 -47.93 69.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.134 -0.484 . . . . 52.02 110.965 -179.986 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 85.7 t80 -70.14 -38.09 75.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.142 -0.481 . . . . 74.22 110.962 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 191' ' ' ALA . . . . . 0.439 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -72.68 -35.4 67.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.098 -0.501 . . . . 50.03 111.027 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 192' ' ' ALA . . . . . 0.672 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -56.8 -44.88 82.38 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.277 -0.42 . . . . 52.11 111.143 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 193' ' ' THR . . . . . 0.587 HG21 ' HE1' ' A' ' 224' ' ' PHE . 0.6 OUTLIER -58.87 -43.04 90.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 72.43 111.177 -179.917 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 11.7 t-160 -72.88 -38.02 67.13 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.166 -0.47 . . . . 71.44 110.861 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -75.5 -47.44 27.02 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.15 -0.477 . . . . 71.01 111.104 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 196' ' ' LEU . . . . . 0.696 HD12 ' CD1' ' A' ' 113' ' ' LEU . 4.6 mm? -63.19 -43.98 96.67 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.234 -0.439 . . . . 74.51 110.864 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -59.14 -28.7 64.43 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.714 -0.755 . . . . 52.23 112.425 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 198' ' ' HIS . . . . . 0.568 ' CD2' HG21 ' A' ' 69' ' ' VAL . 5.1 m-70 -65.69 -32.88 74.68 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.789 0.328 . . . . 75.21 110.817 -179.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.57 -21.17 60.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.24 -0.436 . . . . 71.13 110.849 -179.768 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 200' ' ' LEU . . . . . 0.431 ' HA ' ' CD1' ' A' ' 84' ' ' TRP . 0.6 OUTLIER -88.72 2.3 53.61 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.131 -0.486 . . . . 64.13 110.916 179.946 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 84.12 -9.02 64.78 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.718 -0.753 . . . . 50.41 112.446 179.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 202' ' ' MET . . . . . . . . . . . . . 37.6 tpp -51.51 138.94 21.2 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.806 0.336 . . . . 63.21 110.855 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -105.12 159.06 15.8 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.744 -0.741 . . . . 64.44 112.53 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 16.0 m-70 -55.52 163.38 1.29 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.813 0.34 . . . . 74.32 110.838 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -123.61 147.81 47.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.184 -0.462 . . . . 53.34 110.834 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 206' ' ' SER . . . . . 0.431 ' HB3' ' HA3' ' A' ' 47' ' ' GLY . 0.7 OUTLIER -88.14 -4.03 58.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.128 -0.487 . . . . 72.22 110.854 -179.81 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -70.99 138.58 85.06 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.626 0.727 . . . . 65.11 110.836 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 -8.96 24.91 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.626 2.217 . . . . 74.53 112.37 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -127.98 29.71 5.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.237 -0.438 . . . . 63.52 110.934 179.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 210' ' ' ALA . . . . . 0.457 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.37 145.86 26.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.201 -0.454 . . . . 62.23 111.059 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -67.73 -28.77 42.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.246 -0.434 . . . . 62.04 111.115 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.75 8.84 42.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.149 -0.478 . . . . 75.22 110.908 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 213' ' ' TYR . . . . . 0.411 ' HA ' ' HD2' ' A' ' 214' ' ' PRO . 1.8 t80 -55.73 115.02 8.42 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.703 0.763 . . . . 73.43 110.925 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 214' ' ' PRO . . . . . 0.411 ' HD2' ' HA ' ' A' ' 213' ' ' TYR . 54.3 Cg_endo -69.67 -17.79 37.78 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.711 2.274 . . . . 63.01 112.389 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 215' ' ' THR . . . . . 0.402 ' HB ' ' CE2' ' A' ' 213' ' ' TYR . 0.2 OUTLIER -83.77 55.6 3.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.215 -0.448 . . . . 74.24 111.139 -179.946 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 5.8 t80 . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 116.206 -0.452 . . . . 74.14 110.942 -179.905 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 224' ' ' PHE . . . . . 0.644 ' CD2' HD12 ' A' ' 189' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.925 0.393 . . . . 65.01 110.882 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.75 154.67 43.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 64.24 110.91 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 226' ' ' LEU . . . . . 0.73 HD13 ' HG2' ' A' ' 119' ' ' GLU . 12.0 mt -69.98 148.66 48.62 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.268 -0.424 . . . . 53.44 110.931 179.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 227' ' ' SER . . . . . 0.457 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 0.0 OUTLIER -86.65 155.43 20.41 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.154 -0.476 . . . . 74.21 110.861 -179.886 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 42.6 mt-30 -67.45 -66.09 0.6 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.109 -0.496 . . . . 74.54 110.98 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 229' ' ' ASP . . . . . 0.41 ' O ' ' HG2' ' A' ' 232' ' ' LYS . 1.0 OUTLIER -55.74 -26.63 46.48 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.156 -0.474 . . . . 72.22 110.864 179.959 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -69.1 -50.66 46.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.141 -0.481 . . . . 74.23 110.881 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 231' ' ' ILE . . . . . 0.694 HD11 HD22 ' A' ' 226' ' ' LEU . 2.8 mm -70.43 -42.18 78.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.222 -0.445 . . . . 73.41 111.118 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 232' ' ' LYS . . . . . 0.41 ' HG2' ' O ' ' A' ' 229' ' ' ASP . 0.0 OUTLIER -56.47 -32.34 64.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.22 -0.445 . . . . 65.42 110.904 179.84 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -64.55 -50.01 61.53 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.753 -0.737 . . . . 63.43 112.437 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 5.5 tt -73.19 -30.81 32.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.731 0.301 . . . . 71.54 111.089 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -66.38 -24.16 66.45 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.256 -0.429 . . . . 70.33 110.923 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 236' ' ' LYS . . . . . 0.463 ' HE2' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.1 -20.61 60.21 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.239 -0.437 . . . . 51.21 110.904 179.918 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 237' ' ' LEU . . . . . 0.647 HD22 ' HD2' ' A' ' 83' ' ' LYS . 9.8 tt -97.21 -31.38 12.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.217 -0.447 . . . . 75.41 110.935 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 238' ' ' TYR . . . . . 0.456 ' CZ ' HD11 ' A' ' 122' ' ' LEU . 26.4 m-85 -92.16 -35.02 14.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 51.24 110.901 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.336 0 C-N-CA 120.69 -0.767 . . . . 32.22 112.47 -179.988 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.582 ' CH2' HD23 ' A' ' 54' ' ' LEU . 70.0 t-105 . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.678 0.275 . . . . 71.22 110.872 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -72.2 -35.16 68.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.314 -0.403 . . . . 72.51 110.886 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -71.34 -36.51 71.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.113 -0.494 . . . . 61.24 110.946 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.587 ' HB1' ' SD ' ' A' ' 62' ' ' MET . . . -65.82 -44.1 86.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.254 -0.43 . . . . 54.34 111.076 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.571 ' OE1' HD21 ' A' ' 35' ' ' LEU . 0.0 OUTLIER -73.79 -31.92 63.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.264 -0.425 . . . . 73.12 110.865 -179.92 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.506 ' N ' ' HG3' ' A' ' 16' ' ' GLN . 74.5 m-20 -77.72 -31.09 52.05 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.259 -0.428 . . . . 72.4 110.898 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -59.75 -36.32 76.4 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.175 -0.466 . . . . 75.11 110.902 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.449 HD22 ' HA ' ' A' ' 19' ' ' LEU . 0.2 OUTLIER -72.24 -20.99 61.45 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.19 -0.459 . . . . 72.51 110.911 179.998 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 4.2 ptmt -74.0 -27.86 61.17 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.177 -0.465 . . . . 74.41 110.877 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.0 ptp180 -86.34 -27.73 24.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.23 -0.441 . . . . 74.05 110.804 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -60.16 -21.18 61.34 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.219 -0.446 . . . . 74.31 110.859 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.512 ' HB3' HG21 ' A' ' 72' ' ' VAL . 12.5 m-85 . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.134 -0.484 . . . . 72.55 110.952 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.571 HD21 ' OE1' ' A' ' 16' ' ' GLN . 10.8 mp . . . . . 0 C--O 1.23 0.071 0 CA-C-O 120.781 0.325 . . . . 72.52 110.952 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -61.8 -51.47 68.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.166 -0.47 . . . . 73.13 110.913 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -61.48 -50.51 72.47 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.116 -0.493 . . . . 63.32 111.138 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.83 -38.28 81.57 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.152 -0.476 . . . . 72.32 110.92 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.654 HD21 HD22 ' A' ' 54' ' ' LEU . 1.6 mp -61.63 -39.45 91.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.161 -0.472 . . . . 72.11 110.852 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 37.9 mttp -66.22 -46.71 76.25 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.205 -0.452 . . . . 62.43 110.935 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -70.57 -33.04 70.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.188 -0.46 . . . . 75.11 110.903 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.725 ' CE ' HD11 ' A' ' 61' ' ' ILE . 0.0 OUTLIER -67.31 -47.5 70.38 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.164 -0.471 . . . . 63.43 110.884 179.951 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.947 ' HA ' HD12 ' A' ' 48' ' ' LEU . 31.4 mt-30 -59.0 -42.8 90.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.225 -0.443 . . . . 74.45 110.96 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.3 mmpt? -59.6 -27.76 66.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.223 -0.444 . . . . 71.43 110.874 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -70.56 -37.67 74.04 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.24 -0.436 . . . . 73.32 110.834 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.728 ' CD2' HD12 ' A' ' 61' ' ' ILE . 31.3 m-85 -83.94 9.52 12.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.171 -0.468 . . . . 70.43 110.879 -179.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.457 ' HA2' ' HB3' ' A' ' 206' ' ' SER . . . 76.55 11.81 84.89 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.782 -0.723 . . . . 64.34 112.474 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.947 HD12 ' HA ' ' A' ' 43' ' ' GLN . 6.1 mt -76.4 121.73 85.44 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.56 0.695 . . . . 64.11 110.952 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.83 -44.77 1.84 Allowed 'Trans proline' 0 C--O 1.231 0.16 0 C-N-CA 122.643 2.229 . . . . 74.5 112.35 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 13.1 pt -58.87 129.67 21.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.193 -0.458 . . . . 71.22 111.144 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 76.5 p -115.2 128.88 56.45 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.127 -0.488 . . . . 73.25 111.179 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 90.95 30.03 11.93 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.746 -0.74 . . . . 64.24 112.45 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . 0.749 ' O ' HG21 ' A' ' 58' ' ' VAL . 2.6 mmt -130.98 133.91 46.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.873 0.368 . . . . 75.23 110.845 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.654 HD22 HD21 ' A' ' 39' ' ' LEU . 17.3 tp -154.13 95.94 1.89 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.114 -0.493 . . . . 73.4 110.946 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.402 ' HA ' HG13 ' A' ' 59' ' ' ILE . 1.8 t-20 171.01 -26.48 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.198 -0.455 . . . . 44.35 110.93 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 18.6 m -89.38 -99.62 0.09 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.118 -0.492 . . . . 75.25 110.855 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.638 ' O ' HG23 ' A' ' 61' ' ' ILE . 12.2 tpt85 -84.53 -27.42 27.37 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.199 -0.455 . . . . 61.22 110.905 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.749 HG21 ' O ' ' A' ' 53' ' ' MET . 24.8 t -58.06 -44.31 86.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.143 -0.48 . . . . 70.12 111.119 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.402 HG13 ' HA ' ' A' ' 55' ' ' ASN . 9.9 mm -74.55 -30.89 26.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.147 -0.479 . . . . 74.43 111.219 179.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -59.2 -35.04 72.89 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.119 -0.491 . . . . 73.45 110.892 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.728 HD12 ' CD2' ' A' ' 46' ' ' PHE . 0.4 OUTLIER -76.12 -29.18 19.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.194 -0.457 . . . . 74.52 111.13 179.951 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . 0.587 ' SD ' ' HB1' ' A' ' 15' ' ' ALA . 7.0 mtt -61.76 -39.48 91.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.192 -0.458 . . . . 74.01 110.872 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -81.51 -22.73 37.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.22 -0.445 . . . . 42.22 110.873 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.1 mtmt -85.22 126.45 67.31 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.565 0.698 . . . . 65.34 110.95 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.66 140.1 42.22 Favored 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.72 2.28 . . . . 72.11 112.368 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.521 ' O ' HD23 ' A' ' 156' ' ' LEU . 0.2 OUTLIER -134.87 -77.72 0.45 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.254 -0.43 . . . . 71.51 110.901 -179.983 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -145.26 148.81 33.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.469 . . . . 55.3 110.926 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.594 ' HA3' HG22 ' A' ' 155' ' ' THR . . . -106.46 28.31 13.94 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.678 -0.773 . . . . 64.23 112.52 -179.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.694 HG21 ' CD2' ' A' ' 198' ' ' HIS . 0.2 OUTLIER -106.12 134.26 19.84 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 121.622 0.725 . . . . 74.23 111.135 -179.97 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . 0.467 ' HD2' HG12 ' A' ' 69' ' ' VAL . 54.2 Cg_endo -69.7 132.69 23.96 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.706 2.27 . . . . 63.44 112.326 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -93.29 22.16 5.42 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.245 -0.434 . . . . 74.45 110.887 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.512 HG21 ' HB3' ' A' ' 23' ' ' TYR . 3.1 m . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.154 -0.475 . . . . 53.43 111.124 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo . . . . . 0 C--O 1.231 0.166 0 CA-C-O 120.811 0.255 . . . . 71.11 112.334 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.844 ' HD2' HD22 ' A' ' 237' ' ' LEU . 9.4 mttt -106.56 171.0 7.59 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.189 -0.46 . . . . 64.45 110.954 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 61.0 m95 -56.53 131.15 47.85 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.239 -0.437 . . . . 73.31 110.933 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 4.8 t -115.19 -16.34 11.56 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.172 -0.467 . . . . 65.3 111.089 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 3.3 m -59.06 172.89 0.51 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.247 -0.433 . . . . 70.34 110.887 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 2.8 mptp? -85.04 -21.17 29.51 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.124 -0.489 . . . . 71.12 110.931 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.458 HG23 ' CD2' ' A' ' 123' ' ' HIS . 0.3 OUTLIER -154.8 143.57 13.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.197 -0.456 . . . . 74.14 111.111 179.836 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 25.7 t -119.64 130.44 74.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.167 -0.47 . . . . 72.25 111.171 179.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.671 HG22 ' HB3' ' A' ' 125' ' ' ARG . 43.5 p -115.77 163.53 15.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.471 . . . . 71.01 111.1 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 4.7 p90 -145.96 146.22 30.95 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.207 -0.451 . . . . 70.51 110.923 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 3.7 ttt-85 -151.69 139.09 19.46 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.131 -0.486 . . . . 71.25 110.849 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.522 HD11 ' HA ' ' A' ' 106' ' ' ASP . 11.1 mm -74.84 131.28 35.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.162 -0.472 . . . . 72.4 111.141 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.677 HG22 ' SD ' ' A' ' 135' ' ' MET . 9.3 t -88.6 -40.74 13.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.461 . . . . 60.2 111.183 179.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -151.52 169.36 22.27 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.128 -0.487 . . . . 64.24 110.792 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 13.8 p90 -129.63 155.08 46.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.11 -0.496 . . . . 72.25 110.98 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 2.1 t -102.79 141.84 34.92 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.183 -0.462 . . . . 64.11 111.194 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.44 -18.72 1.78 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.27 -0.423 . . . . 72.14 110.866 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -65.16 -37.32 87.0 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.158 -0.474 . . . . 74.13 110.847 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.413 HD21 ' HA ' ' A' ' 179' ' ' THR . 1.3 mp -142.37 152.82 61.62 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.681 0.753 . . . . 72.52 110.858 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . 0.59 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.4 Cg_endo -69.76 150.97 68.92 Favored 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 122.689 2.259 . . . . 73.11 112.337 179.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 3.7 t-160 -52.7 -25.62 11.53 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.225 -0.443 . . . . 74.11 110.882 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.59 HG22 ' HB2' ' A' ' 101' ' ' PRO . 13.9 tt -77.36 -39.2 27.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.15 -0.477 . . . . 74.02 111.098 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . 0.78 ' O ' HD22 ' A' ' 108' ' ' LEU . 3.6 m -69.13 -36.21 77.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.18 -0.463 . . . . 52.11 111.181 179.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.772 HG13 ' CZ ' ' A' ' 188' ' ' PHE . 60.2 t -71.93 -42.91 68.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.226 -0.443 . . . . 71.51 111.126 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.654 ' O ' HG22 ' A' ' 109' ' ' VAL . 0.0 OUTLIER -67.02 -37.19 83.69 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.171 -0.468 . . . . 63.44 110.845 179.92 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . 0.49 ' HG3' ' N ' ' A' ' 108' ' ' LEU . 0.0 OUTLIER -70.72 -33.27 70.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.172 -0.467 . . . . 75.02 110.891 -179.876 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.78 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -66.44 -47.77 72.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.21 -0.45 . . . . 71.04 110.916 -179.978 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.767 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.5 m -55.03 -42.99 67.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.146 -0.479 . . . . 72.31 111.091 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.493 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 30.2 t -70.62 -33.8 71.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.256 -0.429 . . . . 72.14 110.858 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.465 ' HB3' HD21 ' A' ' 189' ' ' LEU . 0.3 OUTLIER -62.02 -33.11 73.76 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.17 -0.468 . . . . 74.35 110.913 179.914 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.7 -40.14 9.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.188 -0.46 . . . . 74.32 111.048 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.695 ' CD1' HD12 ' A' ' 196' ' ' LEU . 0.4 OUTLIER -64.73 -33.26 75.55 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.249 -0.432 . . . . 72.0 110.909 -179.997 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -66.38 -34.89 78.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.183 -0.462 . . . . 72.34 110.861 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . 0.883 ' HB3' HD23 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -70.24 -33.33 71.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 54.12 110.843 179.927 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' TRP . . . . . 0.602 ' CZ3' HD11 ' A' ' 226' ' ' LEU . 6.3 m95 -70.16 -42.76 72.05 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.232 -0.44 . . . . 75.23 110.898 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -72.89 -40.81 51.21 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.735 -0.745 . . . . 73.32 112.43 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.3 ptpt -61.34 -14.52 27.75 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.802 0.334 . . . . 72.42 110.897 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.641 ' HB3' HG23 ' A' ' 231' ' ' ILE . 41.9 mm-40 -100.69 13.39 35.0 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.241 -0.436 . . . . 75.24 110.838 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 1.133 HD12 HD12 ' A' ' 122' ' ' LEU . 6.6 pt -147.99 144.55 19.12 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.635 0.731 . . . . 71.34 111.099 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.72 24.57 0.17 Allowed 'Trans proline' 0 C--O 1.232 0.221 0 C-N-CA 122.673 2.249 . . . . 72.21 112.367 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 1.133 HD12 HD12 ' A' ' 120' ' ' ILE . 6.3 mt -77.46 -159.71 0.15 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.167 -0.47 . . . . 73.22 110.902 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.458 ' CD2' HG23 ' A' ' 88' ' ' VAL . 3.4 t-160 -151.19 120.98 7.03 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.184 -0.462 . . . . 74.12 110.934 179.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 11.0 m-30 -110.36 148.44 31.97 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.224 -0.443 . . . . 75.54 110.891 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.671 ' HB3' HG22 ' A' ' 90' ' ' THR . 0.0 OUTLIER -129.91 141.35 50.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.125 -0.489 . . . . 75.14 110.853 -179.872 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.14 145.25 31.13 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.247 -0.433 . . . . 72.22 110.875 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . 1.031 HG11 ' HB2' ' A' ' 132' ' ' ALA . 30.4 m -103.3 126.58 57.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.248 -0.433 . . . . 50.13 111.097 179.861 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.464 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -142.07 -22.62 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.116 -0.493 . . . . 74.43 111.187 179.859 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' TRP . . . . . 0.464 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -140.72 109.15 5.86 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.104 -0.498 . . . . 71.25 110.92 179.92 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.07 -162.24 13.53 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.747 -0.74 . . . . 62.11 112.521 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 3.2 m -101.79 156.61 17.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.79 0.329 . . . . 63.25 111.13 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . 1.031 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -111.22 165.2 12.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.218 -0.446 . . . . 51.34 111.136 179.808 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -69.05 -55.33 11.13 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.188 -0.46 . . . . 75.41 110.883 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . 0.428 HG22 ' CD1' ' A' ' 136' ' ' ILE . 41.1 mt -82.7 131.06 34.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.196 -0.456 . . . . 70.51 111.12 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . 0.677 ' SD ' HG22 ' A' ' 94' ' ' VAL . 27.2 mmt -108.06 118.37 36.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.162 -0.472 . . . . 72.43 110.964 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.428 ' CD1' HG22 ' A' ' 134' ' ' ILE . 0.8 OUTLIER -106.16 89.87 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.316 -0.402 . . . . 70.04 111.166 179.955 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . 0.402 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -129.53 169.45 20.73 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.774 -0.726 . . . . 63.34 112.509 179.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' PHE . . . . . 0.605 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 45.5 m-85 -106.04 147.04 29.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.888 0.375 . . . . 74.01 110.945 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.605 ' HB2' ' O ' ' A' ' 138' ' ' PHE . . . 167.48 166.19 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.142 -0.481 . . . . 71.21 111.105 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.426 ' HB2' ' HB3' ' A' ' 149' ' ' PHE . 1.0 OUTLIER -109.28 174.36 5.9 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.216 -0.447 . . . . 62.21 110.832 -179.939 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . 0.547 ' H ' ' HA ' ' A' ' 149' ' ' PHE . . . -54.13 -17.68 8.07 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.783 -0.722 . . . . 74.24 112.461 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 142' ' ' ALA . . . . . 0.534 ' HB2' ' HD2' ' A' ' 149' ' ' PHE . . . -89.36 13.29 13.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.848 0.356 . . . . 75.03 111.159 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' HIS . . . . . 0.451 ' HB3' ' HB1' ' A' ' 139' ' ' ALA . 5.0 p80 -81.09 0.91 33.96 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.191 -0.458 . . . . 71.11 110.859 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 104.61 47.1 1.23 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.828 -0.701 . . . . 45.51 112.521 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -159.46 174.21 15.03 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.795 0.331 . . . . 72.14 110.885 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 57.7 m -63.98 176.42 0.97 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.227 -0.442 . . . . 51.25 110.848 -179.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 64.91 121.39 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.599 0.714 . . . . 73.4 110.908 -179.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.82 151.29 68.67 Favored 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.627 2.218 . . . . 74.53 112.335 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 149' ' ' PHE . . . . . 0.547 ' HA ' ' H ' ' A' ' 141' ' ' GLY . 1.5 p90 -53.93 -30.22 45.51 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.192 -0.458 . . . . 63.52 110.931 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . 0.518 ' CG ' ' O ' ' A' ' 149' ' ' PHE . 2.9 p30 50.03 15.45 0.18 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.135 -0.484 . . . . 63.11 110.851 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . 0.407 ' C ' ' O ' ' A' ' 150' ' ' ASP . . . 37.5 -154.64 0.01 OUTLIER Glycine 0 N--CA 1.453 -0.228 0 C-N-CA 120.698 -0.763 . . . . 71.41 112.518 -179.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 143.51 51.25 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.627 2.218 . . . . 75.11 112.389 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . 0.448 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 105.0 -132.14 10.96 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.809 -0.71 . . . . 70.32 112.493 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 154' ' ' ASN . . . . . 0.448 ' C ' ' O ' ' A' ' 153' ' ' GLY . 2.7 p30 -34.62 142.51 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.954 0.407 . . . . 73.25 110.907 -179.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 155' ' ' THR . . . . . 0.594 HG22 ' HA3' ' A' ' 68' ' ' GLY . 0.3 OUTLIER 69.59 110.06 0.05 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.21 -0.45 . . . . 44.41 111.16 -179.921 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 156' ' ' LEU . . . . . 0.985 HD21 HG21 ' A' ' 186' ' ' ILE . 0.6 OUTLIER -87.97 -54.5 4.2 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.15 -0.477 . . . . 75.02 110.947 179.965 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . 0.575 ' HB1' ' O ' ' A' ' 171' ' ' HIS . . . -163.84 149.18 10.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.209 -0.451 . . . . 71.42 111.092 179.805 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 33.9 p-80 -108.1 123.36 48.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.2 -0.455 . . . . 72.02 110.771 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . 0.45 ' H ' HG22 ' A' ' 69' ' ' VAL . . . -111.05 160.23 17.04 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.154 -0.475 . . . . 74.42 111.152 179.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -110.89 150.77 28.71 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.285 -0.416 . . . . 75.31 110.892 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 161' ' ' ALA . . . . . 0.624 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -79.26 162.1 65.27 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.607 0.718 . . . . 61.04 111.116 179.915 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 162' ' ' PRO . . . . . 0.624 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.5 Cg_endo -69.74 77.82 1.04 Allowed 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.704 2.269 . . . . 74.44 112.315 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -135.18 121.5 2.59 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.697 -0.763 . . . . 61.41 112.52 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 62.61 -173.64 0.15 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.817 0.342 . . . . 73.1 111.144 -179.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -79.09 -49.79 6.17 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.815 -0.707 . . . . 74.03 112.527 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 166' ' ' LEU . . . . . 0.585 HD23 ' O ' ' A' ' 166' ' ' LEU . 6.1 tt -63.78 -37.17 86.37 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.863 0.363 . . . . 65.12 110.874 -179.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -79.18 157.5 42.97 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.725 -0.75 . . . . 43.43 112.454 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 94.42 22.9 23.22 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.719 -0.753 . . . . 74.31 112.542 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 80.6 m-20 -94.4 168.49 10.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.877 0.37 . . . . 63.41 110.789 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -117.11 130.83 56.89 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.124 -0.489 . . . . 74.21 111.042 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 171' ' ' HIS . . . . . 0.575 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 28.1 m170 -126.11 132.14 51.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.2 -0.454 . . . . 72.53 110.85 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 32.3 m-85 -113.75 139.97 48.66 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.214 -0.448 . . . . 71.44 110.876 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 55.3 t0 -71.56 100.25 2.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.112 -0.494 . . . . 74.11 110.831 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.62 -16.53 10.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.227 -0.442 . . . . 72.25 110.823 -179.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -78.46 -16.19 57.81 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.208 -0.451 . . . . 73.32 110.806 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -83.59 -174.54 5.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.255 -0.43 . . . . 63.2 110.969 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 12.9 mtm180 -113.23 116.95 30.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.207 -0.451 . . . . 63.14 110.907 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 44.2 m95 -116.86 137.44 52.21 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.235 -0.439 . . . . 72.31 110.897 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 179' ' ' THR . . . . . 0.567 HG21 ' HB3' ' A' ' 182' ' ' SER . 5.0 t -176.58 163.69 2.42 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.219 -0.446 . . . . 74.13 111.143 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -123.99 -68.69 0.85 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.204 -0.453 . . . . 45.33 110.842 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -66.8 -10.84 56.46 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.755 -0.736 . . . . 62.41 112.492 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 182' ' ' SER . . . . . 0.567 ' HB3' HG21 ' A' ' 179' ' ' THR . 0.3 OUTLIER -96.59 -24.32 16.09 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.912 0.387 . . . . 64.5 110.915 -179.781 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 183' ' ' SER . . . . . 0.448 ' C ' ' O ' ' A' ' 182' ' ' SER . 97.4 p 34.02 63.3 0.41 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.131 -0.486 . . . . 64.12 110.825 -179.9 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 24.8 tp -116.91 -33.64 4.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.18 -0.464 . . . . 74.2 110.889 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -124.51 -135.76 4.49 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.699 -0.762 . . . . 73.01 112.484 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 186' ' ' ILE . . . . . 0.985 HG21 HD21 ' A' ' 156' ' ' LEU . 7.1 mm -79.36 100.09 3.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.775 0.322 . . . . 73.22 111.162 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -50.75 123.79 9.72 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.131 -0.486 . . . . 71.31 110.816 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 188' ' ' PHE . . . . . 0.772 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.6 t80 -54.03 -35.42 61.94 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.121 -0.49 . . . . 75.45 110.873 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . 0.565 HD12 ' HE2' ' A' ' 224' ' ' PHE . 0.2 OUTLIER -67.27 -47.11 71.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.122 -0.49 . . . . 52.02 110.955 179.964 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.16 -40.86 77.92 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.234 -0.439 . . . . 74.22 110.934 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 191' ' ' ALA . . . . . 0.602 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -70.16 -35.05 73.73 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.128 -0.487 . . . . 50.03 111.079 179.847 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 192' ' ' ALA . . . . . 0.707 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -56.81 -43.24 80.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.216 -0.447 . . . . 52.11 111.102 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 193' ' ' THR . . . . . 0.504 HG21 HG21 ' A' ' 211' ' ' VAL . 0.0 OUTLIER -57.86 -42.63 84.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.21 -0.45 . . . . 72.43 111.117 -179.891 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 5.7 t-160 -73.46 -40.23 64.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.182 -0.463 . . . . 71.44 110.905 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -70.69 -48.85 52.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.139 -0.482 . . . . 71.01 111.059 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 196' ' ' LEU . . . . . 0.707 HD23 ' O ' ' A' ' 192' ' ' ALA . 4.2 mm? -64.04 -46.6 83.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 74.51 110.939 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -55.06 -31.97 56.36 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.74 -0.743 . . . . 52.23 112.429 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 198' ' ' HIS . . . . . 0.694 ' CD2' HG21 ' A' ' 69' ' ' VAL . 4.5 m-70 -65.54 -36.42 83.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.855 0.36 . . . . 75.21 110.826 -179.898 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 29.9 t -67.38 -21.05 65.63 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.187 -0.46 . . . . 71.13 110.871 -179.755 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -90.31 -0.07 57.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.141 -0.482 . . . . 64.13 110.935 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 85.01 -7.89 72.83 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.692 -0.766 . . . . 50.41 112.449 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 202' ' ' MET . . . . . . . . . . . . . 28.3 tpp -50.05 139.36 14.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.797 0.332 . . . . 63.21 110.966 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -101.17 159.08 18.85 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.776 -0.726 . . . . 64.44 112.535 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 204' ' ' HIS . . . . . 0.407 ' HA ' ' HB3' ' A' ' 212' ' ' MET . 22.5 m-70 -56.99 154.81 9.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.791 0.329 . . . . 74.32 110.851 -179.901 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -119.3 145.05 46.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.234 -0.439 . . . . 53.34 110.852 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 206' ' ' SER . . . . . 0.457 ' HB3' ' HA2' ' A' ' 47' ' ' GLY . 1.7 m -87.97 -4.26 58.83 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.155 -0.475 . . . . 72.22 110.805 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 207' ' ' ASP . . . . . 0.411 ' HB2' ' HB2' ' A' ' 210' ' ' ALA . 0.6 OUTLIER -71.38 137.7 83.85 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.635 0.731 . . . . 65.11 110.835 179.998 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -69.71 -9.84 27.11 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.704 2.269 . . . . 74.53 112.368 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 -122.01 24.72 9.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.145 -0.479 . . . . 63.52 110.858 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 210' ' ' ALA . . . . . 0.439 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.33 145.17 26.44 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.185 -0.461 . . . . 62.23 111.092 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 211' ' ' VAL . . . . . 0.504 HG21 HG21 ' A' ' 193' ' ' THR . 0.3 OUTLIER -69.5 -27.71 35.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.185 -0.461 . . . . 62.04 111.163 179.925 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 212' ' ' MET . . . . . 0.407 ' HB3' ' HA ' ' A' ' 204' ' ' HIS . 0.0 OUTLIER -92.1 3.65 54.83 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.205 -0.452 . . . . 75.22 110.841 179.935 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 213' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -55.54 110.43 2.25 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-O 121.652 0.739 . . . . 73.43 110.934 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 -18.07 37.17 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.685 2.257 . . . . 63.01 112.31 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -84.11 58.1 4.57 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.247 -0.433 . . . . 74.24 111.136 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 . . . . . 0 C--N 1.328 -0.351 0 CA-C-N 116.246 -0.434 . . . . 74.14 110.907 -179.938 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 224' ' ' PHE . . . . . 0.565 ' HE2' HD12 ' A' ' 189' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.886 0.374 . . . . 65.01 110.922 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -143.23 -167.74 2.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.109 -0.496 . . . . 64.24 110.905 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 226' ' ' LEU . . . . . 0.883 HD23 ' HB3' ' A' ' 115' ' ' MET . 0.5 OUTLIER -59.3 148.67 31.32 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.208 -0.451 . . . . 53.44 110.902 179.935 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 227' ' ' SER . . . . . 0.439 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 2.0 t -87.12 157.4 19.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.192 -0.458 . . . . 74.21 110.926 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -63.44 -63.07 1.28 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.12 -0.491 . . . . 74.54 110.871 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -55.74 -27.77 52.4 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.212 -0.449 . . . . 72.22 110.897 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.22 -48.51 61.76 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.275 -0.42 . . . . 74.23 110.805 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 231' ' ' ILE . . . . . 0.665 HD11 ' HB3' ' A' ' 226' ' ' LEU . 8.3 mt -68.23 -43.07 84.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.213 -0.449 . . . . 73.41 111.1 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 11.8 pttp -66.09 -33.03 74.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.157 -0.474 . . . . 65.42 110.91 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -63.18 -46.78 92.41 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.784 -0.722 . . . . 63.43 112.435 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 7.0 tt -72.9 -30.77 33.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.74 0.305 . . . . 71.54 111.066 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -65.87 -24.3 66.84 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.214 -0.448 . . . . 70.33 110.862 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 236' ' ' LYS . . . . . 0.405 ' HE2' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.64 -28.29 60.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.259 -0.428 . . . . 51.21 110.913 179.992 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 237' ' ' LEU . . . . . 0.844 HD22 ' HD2' ' A' ' 83' ' ' LYS . 7.0 tt -97.77 -31.0 12.46 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.2 -0.455 . . . . 75.41 110.892 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 238' ' ' TYR . . . . . 0.417 ' OH ' HD11 ' A' ' 122' ' ' LEU . 3.7 m-85 -91.85 -35.21 14.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.19 -0.459 . . . . 51.24 110.875 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.248 0 C-N-CA 120.691 -0.766 . . . . 32.22 112.453 179.974 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 3.4 t-105 . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.786 0.327 . . . . 71.22 110.917 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 41.1 mm-40 -71.17 -35.49 71.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.271 -0.422 . . . . 72.51 110.926 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 5.8 mm-40 -68.85 -37.13 78.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.098 -0.501 . . . . 61.24 110.88 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.459 ' HB1' ' HE3' ' A' ' 62' ' ' MET . . . -57.21 -36.95 71.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.2 -0.454 . . . . 54.34 111.059 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.656 ' NE2' HD22 ' A' ' 35' ' ' LEU . 10.6 tt0 -69.87 -42.96 72.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.21 -0.45 . . . . 73.12 110.931 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.413 ' HA ' ' HD2' ' A' ' 20' ' ' LYS . 35.6 m-20 -65.21 -31.56 72.79 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.46 . . . . 72.4 110.808 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 17.5 m-85 -70.42 -36.6 74.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.214 -0.448 . . . . 75.11 110.979 -179.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.634 HD13 ' O ' ' A' ' 19' ' ' LEU . 3.2 tm? -72.01 -26.32 62.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.063 -0.517 . . . . 72.51 110.923 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.413 ' HD2' ' HA ' ' A' ' 17' ' ' ASP . 5.0 ptmt -67.6 -32.18 72.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.175 -0.466 . . . . 74.41 110.882 179.86 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.8 ptp85 -85.91 -26.74 25.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.251 -0.432 . . . . 74.05 110.82 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -74.51 2.36 9.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.255 -0.429 . . . . 74.31 110.868 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.544 ' CE2' HG11 ' A' ' 72' ' ' VAL . 60.3 t80 . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.154 -0.475 . . . . 72.55 110.947 -179.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.656 HD22 ' NE2' ' A' ' 16' ' ' GLN . 31.1 tp . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.733 0.302 . . . . 72.52 110.861 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -57.64 -46.06 84.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.295 -0.412 . . . . 73.13 110.821 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.56 -36.68 84.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.133 -0.485 . . . . 63.32 111.108 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.519 ' HE3' HD12 ' A' ' 19' ' ' LEU . 11.8 mtmt -70.38 -49.31 50.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.171 -0.468 . . . . 72.32 110.845 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.487 HD11 HD22 ' A' ' 54' ' ' LEU . 5.1 mt -59.79 -35.77 75.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.287 -0.415 . . . . 72.11 110.881 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.1 ttmt -58.15 -46.25 85.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.198 -0.455 . . . . 62.43 110.912 179.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -70.37 -36.4 74.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 75.11 110.869 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.9 ttp -69.4 -36.48 76.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.173 -0.467 . . . . 63.43 110.849 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.597 ' HG2' HD11 ' A' ' 48' ' ' LEU . 3.2 mt-30 -66.91 -43.34 83.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.166 -0.47 . . . . 74.45 110.987 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.558 ' HD2' ' N ' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -73.11 -20.83 60.85 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.191 -0.459 . . . . 71.43 110.921 179.886 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.558 ' N ' ' HD2' ' A' ' 44' ' ' LYS . 89.1 t80 -71.22 -37.6 72.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.241 -0.436 . . . . 73.32 110.945 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.833 ' CZ ' HD13 ' A' ' 61' ' ' ILE . 6.1 m-85 -81.91 -28.4 32.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.109 -0.496 . . . . 70.43 110.841 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 106.45 -10.44 42.48 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.723 -0.751 . . . . 64.34 112.538 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.597 HD11 ' HG2' ' A' ' 43' ' ' GLN . 0.9 OUTLIER -63.47 138.61 97.41 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.65 0.738 . . . . 64.11 110.863 -179.858 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.84 -54.04 0.24 Allowed 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.664 2.243 . . . . 74.5 112.38 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.689 HD11 ' HB3' ' A' ' 57' ' ' ARG . 0.7 OUTLIER -50.08 107.97 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.24 -0.436 . . . . 71.22 111.074 179.931 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 3.6 p -111.0 167.07 10.53 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.197 -0.456 . . . . 73.25 111.174 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 57.68 19.59 35.99 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.739 -0.743 . . . . 64.24 112.538 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.1 mtt -119.55 161.09 21.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.795 0.331 . . . . 75.23 110.883 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.487 HD22 HD11 ' A' ' 39' ' ' LEU . 26.2 tp -164.35 85.38 0.44 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.27 -0.423 . . . . 73.4 110.99 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.424 ' HA ' HG13 ' A' ' 59' ' ' ILE . 0.5 OUTLIER 175.52 -29.17 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.188 -0.46 . . . . 44.35 110.86 179.907 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 23.5 m -89.77 -101.29 0.1 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.235 -0.439 . . . . 75.25 110.811 -179.826 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.689 ' HB3' HD11 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -84.79 -28.54 26.09 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.125 -0.489 . . . . 61.22 110.927 -179.944 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.654 HG23 HD12 ' A' ' 50' ' ' ILE . 43.6 t -64.63 -42.69 95.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.125 -0.489 . . . . 70.12 111.12 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.424 HG13 ' HA ' ' A' ' 55' ' ' ASN . 1.5 mm -74.61 -31.43 27.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.161 -0.472 . . . . 74.43 111.127 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -58.97 -40.16 83.93 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.15 -0.477 . . . . 73.45 110.913 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.833 HD13 ' CZ ' ' A' ' 46' ' ' PHE . 1.2 pp -68.17 -28.98 42.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.088 -0.505 . . . . 74.52 111.124 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . 0.459 ' HE3' ' HB1' ' A' ' 15' ' ' ALA . 3.3 mmt -60.54 -40.19 90.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.182 -0.463 . . . . 74.01 110.891 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -84.46 -23.76 29.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.219 -0.446 . . . . 42.22 110.892 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.37 112.1 41.59 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.533 0.682 . . . . 65.34 110.873 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 151.8 69.12 Favored 'Trans proline' 0 N--CA 1.465 -0.188 0 C-N-CA 122.707 2.271 . . . . 72.11 112.367 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -145.75 -68.84 0.28 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.217 -0.447 . . . . 71.51 110.843 -179.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -145.21 151.89 39.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.243 -0.435 . . . . 55.3 110.889 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.652 ' HA2' HG23 ' A' ' 155' ' ' THR . . . -88.02 4.27 85.59 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.742 -0.742 . . . . 64.23 112.495 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.49 HG21 ' CD2' ' A' ' 198' ' ' HIS . 0.2 OUTLIER -92.89 135.24 26.28 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.645 0.735 . . . . 74.23 111.111 -179.912 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . 0.486 ' HD2' HG12 ' A' ' 69' ' ' VAL . 53.6 Cg_endo -69.78 151.93 69.1 Favored 'Trans proline' 0 C--O 1.231 0.143 0 C-N-CA 122.679 2.253 . . . . 63.44 112.321 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -58.91 -30.86 68.13 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.166 -0.47 . . . . 74.45 110.864 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.544 HG11 ' CE2' ' A' ' 23' ' ' TYR . 8.9 m . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.208 -0.451 . . . . 53.43 111.111 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 C--O 1.232 0.181 0 CA-C-O 120.855 0.273 . . . . 71.11 112.319 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.644 ' HD2' HD22 ' A' ' 237' ' ' LEU . 20.4 mttp -78.31 161.16 27.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.263 -0.426 . . . . 64.45 110.849 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . 0.432 ' CD1' ' HA ' ' A' ' 200' ' ' LEU . 27.2 m95 -49.88 116.42 1.8 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.217 -0.447 . . . . 73.31 110.906 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.434 HG22 ' O ' ' A' ' 85' ' ' THR . 6.4 m -115.17 1.05 13.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.262 -0.427 . . . . 65.3 111.132 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.8 m -66.33 -176.61 0.45 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.197 -0.456 . . . . 70.34 110.842 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 4.0 mttt -92.07 -23.08 19.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.102 -0.499 . . . . 71.12 110.94 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -154.29 143.49 13.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.226 -0.443 . . . . 74.14 111.064 179.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 99.6 t -117.81 130.36 72.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.142 -0.481 . . . . 72.25 111.119 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.644 HG22 ' HB3' ' A' ' 125' ' ' ARG . 28.8 p -122.09 162.34 21.42 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.16 -0.473 . . . . 71.01 111.157 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 4.0 p90 -151.24 146.59 26.17 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.223 -0.444 . . . . 70.51 110.932 -179.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 10.4 ttt180 -148.36 135.88 20.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.124 -0.489 . . . . 71.25 110.899 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.405 HG13 ' HB ' ' A' ' 136' ' ' ILE . 3.9 mp -74.82 135.46 27.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.205 -0.452 . . . . 72.4 111.173 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.417 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 19.9 t -90.33 -40.48 12.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.19 -0.459 . . . . 60.2 111.105 179.909 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 40.9 t -144.16 164.45 30.65 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.174 -0.466 . . . . 64.24 110.863 -179.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 6.1 p90 -111.47 153.41 26.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.159 -0.473 . . . . 72.25 110.958 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.486 ' OG1' HG21 ' A' ' 105' ' ' VAL . 0.2 OUTLIER -82.61 140.97 32.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.128 -0.487 . . . . 64.11 111.136 -179.949 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 10.8 ptp180 -73.21 -7.88 53.38 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.214 -0.448 . . . . 72.14 110.893 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -96.42 -26.05 15.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.232 -0.44 . . . . 74.13 110.927 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.614 HD21 ' HA ' ' A' ' 179' ' ' THR . 0.5 OUTLIER -133.55 153.75 80.44 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.57 0.7 . . . . 72.52 110.928 -179.936 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . 0.603 ' HB2' HG22 ' A' ' 103' ' ' ILE . 54.5 Cg_endo -69.7 150.9 69.16 Favored 'Trans proline' 0 N--CA 1.465 -0.187 0 C-N-CA 122.744 2.296 . . . . 73.11 112.359 179.825 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 16.3 t-160 -53.22 -25.79 15.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.304 -0.407 . . . . 74.11 110.817 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.603 HG22 ' HB2' ' A' ' 101' ' ' PRO . 15.2 tt -76.62 -39.15 31.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.449 . . . . 74.02 111.119 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . 0.664 ' O ' HD22 ' A' ' 108' ' ' LEU . 3.3 m -69.2 -38.91 78.86 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.166 -0.47 . . . . 52.11 111.157 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.733 ' O ' HG13 ' A' ' 109' ' ' VAL . 97.3 t -72.72 -44.85 58.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.172 -0.467 . . . . 71.51 111.111 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.685 ' O ' HG22 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -66.27 -41.79 89.39 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.257 -0.429 . . . . 63.44 110.851 179.893 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -70.04 -34.23 72.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 75.02 110.909 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.664 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -61.05 -48.1 83.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.162 -0.472 . . . . 71.04 110.935 -179.991 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.733 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.4 m -55.37 -41.37 61.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.218 -0.446 . . . . 72.31 111.095 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.463 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 32.1 t -70.08 -33.8 72.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.17 -0.468 . . . . 72.14 110.894 -179.807 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.41 ' CG ' HD21 ' A' ' 189' ' ' LEU . 0.3 OUTLIER -62.28 -33.26 74.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.09 -0.504 . . . . 74.35 110.873 179.951 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -95.68 -40.53 9.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.219 -0.446 . . . . 74.32 111.114 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.722 ' CD1' HD12 ' A' ' 196' ' ' LEU . 0.4 OUTLIER -65.32 -32.8 74.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.263 -0.426 . . . . 72.0 110.954 -179.984 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 15.4 t30 -65.49 -39.85 92.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.172 -0.467 . . . . 72.34 110.887 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . 0.777 ' O ' HD11 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -59.85 -34.95 73.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.107 -0.497 . . . . 54.12 110.868 179.951 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' TRP . . . . . 0.429 ' CG ' HD11 ' A' ' 200' ' ' LEU . 28.2 m95 -66.59 -52.28 47.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.282 -0.417 . . . . 75.23 110.947 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -60.13 -36.17 89.79 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.754 -0.736 . . . . 73.32 112.45 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.3 mmpt? -64.67 -14.09 56.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.724 0.297 . . . . 72.42 110.95 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.457 ' HG2' HG23 ' A' ' 120' ' ' ILE . 0.6 OUTLIER -99.11 -13.81 19.64 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.226 -0.443 . . . . 75.24 110.873 179.974 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 1.12 HD12 HD12 ' A' ' 122' ' ' LEU . 6.9 pt -122.79 142.92 38.95 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.619 0.723 . . . . 71.34 111.121 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.8 8.54 0.75 Allowed 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.708 2.272 . . . . 72.21 112.364 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 1.12 HD12 HD12 ' A' ' 120' ' ' ILE . 16.4 mt -61.26 -163.17 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.216 -0.447 . . . . 73.22 110.938 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.401 ' H ' ' HB3' ' A' ' 122' ' ' LEU . 3.3 t60 -144.87 122.98 12.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.196 -0.457 . . . . 74.12 110.861 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 9.2 m-30 -107.49 141.47 38.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 75.54 110.86 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.644 ' HB3' HG22 ' A' ' 90' ' ' THR . 0.0 OUTLIER -125.93 141.63 51.88 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.164 -0.471 . . . . 75.14 110.911 -179.931 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.85 152.5 28.15 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.263 -0.426 . . . . 72.22 110.876 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . 0.893 HG11 ' HB2' ' A' ' 132' ' ' ALA . 29.3 m -103.17 126.24 57.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.176 -0.466 . . . . 50.13 111.137 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.606 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -144.9 -11.08 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.151 -0.477 . . . . 74.43 111.126 179.994 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' TRP . . . . . 0.606 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -157.0 109.24 2.46 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.166 -0.47 . . . . 71.25 110.869 -179.996 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 108.22 -162.49 13.06 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.726 -0.749 . . . . 62.11 112.505 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.88 156.35 17.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.79 0.328 . . . . 63.25 111.132 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . 0.893 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -111.62 165.28 12.15 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.196 -0.456 . . . . 51.34 111.109 179.852 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -73.41 -55.1 6.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 75.41 110.819 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . 0.439 HD12 ' N ' ' A' ' 134' ' ' ILE . 4.8 mp -92.68 107.48 19.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.205 -0.452 . . . . 70.51 111.143 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . 0.417 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 14.0 mmm -91.54 128.18 37.27 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.207 -0.451 . . . . 72.43 110.887 179.849 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.405 ' HB ' HG13 ' A' ' 93' ' ' ILE . 0.6 OUTLIER -106.13 94.74 3.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.263 -0.426 . . . . 70.04 111.098 179.976 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -134.59 160.56 24.27 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.732 -0.747 . . . . 63.34 112.47 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' PHE . . . . . 0.571 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 49.2 m-85 -105.08 149.53 25.76 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.82 0.343 . . . . 74.01 110.912 -179.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.571 ' HB2' ' O ' ' A' ' 138' ' ' PHE . . . 169.43 166.83 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.203 -0.453 . . . . 71.21 111.074 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -104.44 173.27 6.38 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.189 -0.459 . . . . 62.21 110.928 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -55.36 -17.1 11.2 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.72 -0.753 . . . . 74.24 112.524 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -88.3 12.93 12.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.829 0.347 . . . . 75.03 111.109 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 5.9 p80 -80.67 -22.11 40.73 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.184 -0.462 . . . . 71.11 110.939 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 139.34 38.7 0.1 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.808 -0.71 . . . . 45.51 112.495 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 54.1 p-10 -150.18 152.01 33.98 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.823 0.344 . . . . 72.14 110.869 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 96.0 p -73.4 -179.74 3.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.175 -0.466 . . . . 51.25 110.861 -179.747 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 68.6 121.08 0.03 OUTLIER Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.659 0.742 . . . . 73.4 110.897 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.75 144.88 55.52 Favored 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 122.665 2.243 . . . . 74.53 112.391 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 149' ' ' PHE . . . . . 0.424 ' CE1' ' HB2' ' A' ' 173' ' ' ASP . 0.1 OUTLIER -90.89 -32.78 15.89 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.182 -0.463 . . . . 63.52 110.926 -179.975 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 73.88 -1.26 3.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.158 -0.474 . . . . 63.11 110.859 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 49.58 -108.37 0.44 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.809 -0.71 . . . . 71.41 112.504 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.84 139.61 40.37 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.58 2.186 . . . . 75.11 112.419 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 103.23 -155.16 18.08 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.745 -0.741 . . . . 70.32 112.497 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 154' ' ' ASN . . . . . 0.436 ' O ' ' CB ' ' A' ' 155' ' ' THR . 2.9 p30 -42.06 153.75 0.06 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.989 0.423 . . . . 73.25 110.857 -179.834 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 155' ' ' THR . . . . . 0.652 HG23 ' HA2' ' A' ' 68' ' ' GLY . 1.2 m 80.15 114.53 0.06 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.149 -0.478 . . . . 44.41 111.155 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 156' ' ' LEU . . . . . 1.085 HD21 HG21 ' A' ' 186' ' ' ILE . 0.7 OUTLIER -99.72 -51.64 3.68 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.255 -0.43 . . . . 75.02 110.984 179.928 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . 0.552 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -163.4 148.11 11.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.176 -0.465 . . . . 71.42 111.12 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 21.3 p-80 -108.13 124.92 50.98 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.257 -0.428 . . . . 72.02 110.873 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . 0.446 ' H ' HG22 ' A' ' 69' ' ' VAL . . . -110.73 156.26 21.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.239 -0.437 . . . . 74.42 111.065 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 13.0 m-30 -117.05 150.89 37.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.208 -0.451 . . . . 75.31 110.864 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 161' ' ' ALA . . . . . 0.71 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -79.87 164.55 52.52 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 121.591 0.71 . . . . 61.04 111.078 179.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 162' ' ' PRO . . . . . 0.71 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.7 Cg_endo -69.76 78.38 1.01 Allowed 'Trans proline' 0 C--N 1.341 0.156 0 C-N-CA 122.707 2.271 . . . . 74.44 112.316 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -140.29 128.55 3.88 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.722 -0.752 . . . . 61.41 112.507 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 64.64 -169.96 0.2 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.848 0.356 . . . . 73.1 111.113 -179.87 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -85.63 -49.86 4.2 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.727 -0.749 . . . . 74.03 112.483 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 166' ' ' LEU . . . . . 0.648 HD23 ' O ' ' A' ' 166' ' ' LEU . 8.2 tt -68.14 -27.52 66.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.869 0.366 . . . . 65.12 110.947 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -84.04 159.92 36.34 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.801 -0.714 . . . . 43.43 112.467 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 88.26 23.07 38.69 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.766 -0.731 . . . . 74.31 112.498 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 -101.14 164.4 11.81 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.862 0.363 . . . . 63.41 110.83 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.13 130.44 55.9 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.16 -0.473 . . . . 74.21 111.118 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 171' ' ' HIS . . . . . 0.439 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 21.2 m170 -125.9 158.54 34.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.242 -0.435 . . . . 72.53 110.81 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -139.45 139.09 36.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.176 -0.466 . . . . 71.44 110.898 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 173' ' ' ASP . . . . . 0.424 ' HB2' ' CE1' ' A' ' 149' ' ' PHE . 67.1 t0 -67.65 97.61 0.63 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.165 -0.47 . . . . 74.11 110.863 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.05 -16.05 11.44 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.137 -0.483 . . . . 72.25 110.905 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -79.16 -16.42 56.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.135 -0.484 . . . . 73.32 110.832 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 37.2 mm-40 -83.17 -173.66 4.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.158 -0.474 . . . . 63.2 110.927 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 78.7 mtt180 -110.33 110.92 21.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.222 -0.445 . . . . 63.14 110.935 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 68.1 m95 -110.86 134.39 52.58 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.196 -0.456 . . . . 72.31 110.957 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 179' ' ' THR . . . . . 0.614 ' HA ' HD21 ' A' ' 100' ' ' LEU . 7.4 t -177.28 163.62 2.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.225 -0.443 . . . . 74.13 111.077 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -125.22 -70.25 0.75 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.165 -0.471 . . . . 45.33 110.847 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -63.06 -13.42 48.43 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.804 -0.712 . . . . 62.41 112.529 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 182' ' ' SER . . . . . 0.508 ' HB3' HG21 ' A' ' 179' ' ' THR . 0.3 OUTLIER -93.1 -24.44 18.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.885 0.374 . . . . 64.5 110.89 -179.739 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 183' ' ' SER . . . . . 0.418 ' C ' ' O ' ' A' ' 182' ' ' SER . 89.5 p 36.04 58.53 0.95 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 64.12 110.866 -179.814 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -116.85 -33.48 4.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.154 -0.475 . . . . 74.2 110.894 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -119.52 -138.58 5.76 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.713 -0.756 . . . . 73.01 112.491 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 186' ' ' ILE . . . . . 1.085 HG21 HD21 ' A' ' 156' ' ' LEU . 9.2 mm -79.49 102.98 5.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 120.798 0.332 . . . . 73.22 111.115 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -48.96 119.54 3.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.202 -0.454 . . . . 71.31 110.866 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 188' ' ' PHE . . . . . 0.589 ' HD2' ' HB3' ' A' ' 108' ' ' LEU . 1.3 t80 -53.94 -33.72 57.59 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.172 -0.467 . . . . 75.45 110.914 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . 0.592 HD12 ' CD2' ' A' ' 224' ' ' PHE . 0.1 OUTLIER -67.1 -47.49 71.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.101 -0.499 . . . . 52.02 110.995 179.955 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.42 -42.54 74.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.16 -0.473 . . . . 74.22 110.927 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 191' ' ' ALA . . . . . 0.524 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -68.92 -35.28 76.63 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.125 -0.489 . . . . 50.03 111.124 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 192' ' ' ALA . . . . . 0.655 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -56.84 -43.08 80.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.256 -0.429 . . . . 52.11 111.071 179.886 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 193' ' ' THR . . . . . 0.788 HG21 HG21 ' A' ' 211' ' ' VAL . 0.2 OUTLIER -57.65 -41.45 81.47 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.208 -0.451 . . . . 72.43 111.113 -179.851 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 5.3 t-160 -73.34 -45.62 54.06 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.207 -0.451 . . . . 71.44 110.888 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -67.49 -48.91 65.74 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.157 -0.474 . . . . 71.01 111.057 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 196' ' ' LEU . . . . . 0.722 HD12 ' CD1' ' A' ' 113' ' ' LEU . 4.2 mm? -66.31 -37.36 85.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.293 -0.412 . . . . 74.51 110.924 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 197' ' ' GLY . . . . . 0.405 ' O ' ' HB3' ' A' ' 202' ' ' MET . . . -65.4 -28.49 73.64 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.744 -0.741 . . . . 52.23 112.461 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 198' ' ' HIS . . . . . 0.49 ' CD2' HG21 ' A' ' 69' ' ' VAL . 4.0 m-70 -66.87 -37.9 85.29 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.84 0.352 . . . . 75.21 110.873 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -64.46 -20.92 66.48 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.218 -0.446 . . . . 71.13 110.808 -179.764 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 200' ' ' LEU . . . . . 0.432 ' HA ' ' CD1' ' A' ' 84' ' ' TRP . 0.6 OUTLIER -88.5 0.63 56.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.216 -0.447 . . . . 64.13 110.854 -179.969 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 84.1 -6.34 75.88 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.807 -0.711 . . . . 50.41 112.452 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 202' ' ' MET . . . . . 0.406 ' HE1' ' HB ' ' A' ' 234' ' ' ILE . 36.5 tpp -50.27 139.27 15.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.877 0.37 . . . . 63.21 110.798 -180.0 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -103.26 158.98 17.3 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.751 -0.738 . . . . 64.44 112.438 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 27.3 m-70 -58.22 150.96 20.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.784 0.326 . . . . 74.32 110.881 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -116.39 146.87 42.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.261 -0.427 . . . . 53.34 110.814 -179.754 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 88.7 p -87.96 -4.74 58.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.106 -0.497 . . . . 72.22 110.889 -179.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.64 136.47 83.26 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.61 0.719 . . . . 65.11 110.849 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.75 -8.21 23.02 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.681 2.254 . . . . 74.53 112.417 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -122.92 23.02 9.5 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.16 -0.473 . . . . 63.52 110.948 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 210' ' ' ALA . . . . . 0.444 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.25 145.81 26.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.08 -0.509 . . . . 62.23 111.102 179.841 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 211' ' ' VAL . . . . . 0.788 HG21 HG21 ' A' ' 193' ' ' THR . 0.4 OUTLIER -69.55 -29.01 39.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.229 -0.441 . . . . 62.04 111.132 179.983 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -93.53 10.36 32.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.151 -0.477 . . . . 75.22 110.882 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 213' ' ' TYR . . . . . 0.407 ' HA ' ' HD2' ' A' ' 214' ' ' PRO . 2.3 t80 -55.56 114.68 7.74 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-O 121.699 0.761 . . . . 73.43 110.958 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 214' ' ' PRO . . . . . 0.407 ' HD2' ' HA ' ' A' ' 213' ' ' TYR . 53.5 Cg_endo -69.76 -20.0 35.41 Favored 'Trans proline' 0 C--O 1.232 0.211 0 C-N-CA 122.639 2.226 . . . . 63.01 112.315 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -86.45 49.18 1.75 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.255 -0.43 . . . . 74.24 111.128 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 6.5 t80 . . . . . 0 C--N 1.328 -0.357 0 CA-C-N 116.251 -0.431 . . . . 74.14 110.937 -179.935 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 224' ' ' PHE . . . . . 0.592 ' CD2' HD12 ' A' ' 189' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.935 0.398 . . . . 65.01 110.866 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -143.19 163.01 34.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.165 -0.47 . . . . 64.24 110.941 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 226' ' ' LEU . . . . . 0.777 HD11 ' O ' ' A' ' 115' ' ' MET . 14.9 mt -61.77 148.99 41.23 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.276 -0.42 . . . . 53.44 110.968 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 227' ' ' SER . . . . . 0.444 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 0.3 OUTLIER -86.95 148.33 25.38 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.237 -0.438 . . . . 74.21 110.787 -179.836 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -60.5 -68.71 0.27 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.14 -0.482 . . . . 74.54 110.935 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.48 -25.42 36.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.217 -0.447 . . . . 72.22 110.828 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -68.89 -48.31 63.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.196 -0.456 . . . . 74.23 110.86 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 231' ' ' ILE . . . . . 0.678 HD11 ' HB3' ' A' ' 226' ' ' LEU . 8.0 mt -68.55 -42.67 83.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.236 -0.438 . . . . 73.41 111.096 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 14.0 ptmt -64.73 -32.38 74.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.242 -0.435 . . . . 65.42 110.889 179.826 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -62.9 -50.07 66.96 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.767 -0.73 . . . . 63.43 112.475 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 234' ' ' ILE . . . . . 0.406 ' HB ' ' HE1' ' A' ' 202' ' ' MET . 0.3 OUTLIER -73.15 -30.5 31.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.862 0.363 . . . . 71.54 111.195 179.98 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 15.3 mt-30 -67.13 -24.28 65.9 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.136 -0.483 . . . . 70.33 110.984 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 236' ' ' LYS . . . . . 0.418 ' HE2' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.09 -26.59 60.45 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.143 -0.481 . . . . 51.21 110.874 179.937 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 237' ' ' LEU . . . . . 0.663 ' O ' HD23 ' A' ' 237' ' ' LEU . 8.1 tt -97.63 -28.94 13.7 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.22 -0.445 . . . . 75.41 110.949 179.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 238' ' ' TYR . . . . . 0.538 ' CE1' HD11 ' A' ' 122' ' ' LEU . 21.4 m-85 -92.11 -35.15 14.05 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.19 -0.459 . . . . 51.24 110.958 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.299 0 C-N-CA 120.756 -0.735 . . . . 32.22 112.504 179.919 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.545 ' CH2' HD23 ' A' ' 54' ' ' LEU . 40.5 t-105 . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.763 0.316 . . . . 71.22 110.92 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -67.61 -35.47 79.02 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.274 -0.421 . . . . 72.51 110.93 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 16.9 mm-40 -65.73 -36.72 84.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.108 -0.496 . . . . 61.24 110.905 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.461 ' O ' ' HE3' ' A' ' 62' ' ' MET . . . -57.28 -38.91 74.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.234 -0.439 . . . . 54.34 111.059 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.62 ' NE2' HD13 ' A' ' 35' ' ' LEU . 0.4 OUTLIER -72.7 -42.98 63.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.212 -0.449 . . . . 73.12 110.867 -179.955 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.527 ' O ' ' HG3' ' A' ' 20' ' ' LYS . 2.9 m-20 -67.06 -31.49 72.04 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.258 -0.428 . . . . 72.4 110.86 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.478 ' HA ' ' HG2' ' A' ' 21' ' ' ARG . 3.2 m-85 -72.07 -43.07 65.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.153 -0.476 . . . . 75.11 110.914 -179.809 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.48 HD13 ' C ' ' A' ' 19' ' ' LEU . 3.1 tm? -73.61 -33.78 64.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.471 . . . . 72.51 110.879 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.527 ' HG3' ' O ' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -73.06 -35.84 66.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.183 -0.462 . . . . 74.41 110.927 179.769 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.478 ' HG2' ' HA ' ' A' ' 18' ' ' TYR . 0.6 OUTLIER -71.5 -27.96 63.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.208 -0.451 . . . . 74.05 110.869 -179.956 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -60.08 -25.28 65.28 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.193 -0.458 . . . . 74.31 110.833 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 116.203 -0.453 . . . . 72.55 110.899 -179.854 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.62 HD13 ' NE2' ' A' ' 16' ' ' GLN . 5.1 tp . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.797 0.332 . . . . 72.52 110.96 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.3 -51.38 63.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.197 -0.456 . . . . 73.13 110.899 179.865 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.34 -38.91 92.99 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.2 -0.454 . . . . 63.32 111.186 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.451 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 2.3 mmtt -69.34 -42.11 75.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.226 -0.443 . . . . 72.32 110.836 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.565 HD21 HD22 ' A' ' 54' ' ' LEU . 1.7 mp -54.48 -38.71 66.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.317 -0.401 . . . . 72.11 110.922 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -58.69 -45.42 89.51 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.171 -0.468 . . . . 62.43 110.905 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.451 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 1.5 pt-20 -60.67 -32.85 72.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.27 -0.423 . . . . 75.11 110.89 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 9.0 ttt -68.52 -34.1 75.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.113 -0.494 . . . . 63.43 110.884 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.654 ' CD ' HD11 ' A' ' 48' ' ' LEU . 2.5 mm100 -59.95 -39.42 85.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.209 -0.45 . . . . 74.45 110.935 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.9 mmpt? -71.57 -30.6 66.04 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.163 -0.472 . . . . 71.43 110.895 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -70.46 -43.5 69.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.225 -0.443 . . . . 73.32 110.875 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.843 ' CZ ' HD13 ' A' ' 61' ' ' ILE . 6.6 m-85 -82.01 -34.95 29.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.127 -0.488 . . . . 70.43 110.852 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.404 ' HA2' ' HB3' ' A' ' 206' ' ' SER . . . 103.07 -6.97 51.78 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.733 -0.746 . . . . 64.34 112.455 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.654 HD11 ' CD ' ' A' ' 43' ' ' GLN . 0.6 OUTLIER -59.85 137.28 90.4 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-O 121.657 0.741 . . . . 64.11 110.911 -179.893 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.69 -52.23 0.34 Allowed 'Trans proline' 0 C--N 1.343 0.239 0 C-N-CA 122.675 2.25 . . . . 74.5 112.32 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.599 HD12 HG23 ' A' ' 58' ' ' VAL . 0.9 OUTLIER -50.96 108.29 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.206 -0.452 . . . . 71.22 111.186 179.95 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.419 ' HA ' ' HG3' ' A' ' 43' ' ' GLN . 3.6 p -99.21 152.48 19.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.18 -0.464 . . . . 73.25 111.197 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 59.2 17.73 39.23 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.761 -0.733 . . . . 64.24 112.472 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 15.2 mmt -102.8 161.04 14.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.828 0.347 . . . . 75.23 110.848 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.565 HD22 HD21 ' A' ' 39' ' ' LEU . 29.5 tp -168.54 81.94 0.16 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.186 -0.461 . . . . 73.4 110.854 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.405 ' HA ' HG13 ' A' ' 59' ' ' ILE . 0.3 OUTLIER 174.5 -28.09 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.227 -0.442 . . . . 44.35 110.936 179.877 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.8 p -87.85 -99.86 0.08 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.121 -0.49 . . . . 75.25 110.843 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.664 ' O ' HG23 ' A' ' 61' ' ' ILE . 17.4 tpt180 -84.97 -29.16 25.3 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.108 -0.496 . . . . 61.22 110.904 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.599 HG23 HD12 ' A' ' 50' ' ' ILE . 84.7 t -60.95 -45.04 99.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.225 -0.443 . . . . 70.12 111.126 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.432 HD13 ' HA ' ' A' ' 59' ' ' ILE . 7.6 mm -75.37 -31.66 24.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.202 -0.454 . . . . 74.43 111.111 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.6 -44.1 93.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.196 -0.457 . . . . 73.45 110.886 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.843 HD13 ' CZ ' ' A' ' 46' ' ' PHE . 1.5 pp -66.82 -29.47 46.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.165 -0.47 . . . . 74.52 111.184 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . 0.461 ' HE3' ' O ' ' A' ' 15' ' ' ALA . 8.2 mmt -63.0 -38.67 92.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.161 -0.472 . . . . 74.01 110.844 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -84.49 -25.71 28.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.254 -0.43 . . . . 42.22 110.934 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.42 136.24 37.79 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.547 0.689 . . . . 65.34 110.924 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -69.82 156.84 62.16 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.731 2.287 . . . . 72.11 112.28 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.464 ' HG3' ' HA ' ' A' ' 214' ' ' PRO . 13.1 ttp180 -149.88 -83.89 0.1 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.181 -0.463 . . . . 71.51 110.89 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -145.58 153.9 41.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.181 -0.463 . . . . 55.3 110.893 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.554 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -108.02 24.58 22.83 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.745 -0.74 . . . . 64.23 112.457 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.625 HG21 ' CD2' ' A' ' 198' ' ' HIS . 0.2 OUTLIER -106.69 134.38 19.85 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 121.629 0.728 . . . . 74.23 111.065 -179.947 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . 0.48 ' HD2' HG12 ' A' ' 69' ' ' VAL . 53.9 Cg_endo -69.75 143.32 50.53 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.717 2.278 . . . . 63.44 112.289 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -102.08 24.52 9.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.233 -0.44 . . . . 74.45 110.878 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 3.9 m . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.221 -0.445 . . . . 53.43 111.13 -179.968 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 C--O 1.231 0.142 0 CA-C-O 120.901 0.292 . . . . 71.11 112.367 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.679 ' HD2' HD22 ' A' ' 237' ' ' LEU . 4.4 mttp -78.82 165.85 23.09 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.217 -0.447 . . . . 64.45 110.91 179.873 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . 0.414 ' CD1' ' HA ' ' A' ' 200' ' ' LEU . 52.6 m95 -49.71 137.72 15.49 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.235 -0.439 . . . . 73.31 110.864 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 2.2 t -115.28 -27.14 7.35 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.207 -0.451 . . . . 65.3 111.112 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -53.19 171.41 0.07 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.215 -0.448 . . . . 70.34 110.808 -179.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.58 -30.69 20.33 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.133 -0.485 . . . . 71.12 110.905 179.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.464 HG23 ' CD2' ' A' ' 123' ' ' HIS . 1.0 OUTLIER -148.39 140.43 18.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.214 -0.448 . . . . 74.14 111.108 179.888 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 90.4 t -123.35 141.39 43.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.155 -0.475 . . . . 72.25 111.106 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.758 HG22 ' HB3' ' A' ' 125' ' ' ARG . 15.2 p -115.61 155.16 28.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.188 -0.46 . . . . 71.01 111.202 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.437 ' O ' HG21 ' A' ' 127' ' ' VAL . 3.9 p90 -137.42 146.61 44.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.265 -0.425 . . . . 70.51 110.911 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.53 ' HB3' ' HB3' ' A' ' 132' ' ' ALA . 7.7 ttt-85 -150.87 139.09 20.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.123 -0.49 . . . . 71.25 110.9 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.543 HD11 ' HA ' ' A' ' 106' ' ' ASP . 10.3 mm -75.2 133.97 30.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.197 -0.456 . . . . 72.4 111.099 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.679 HG22 ' SD ' ' A' ' 135' ' ' MET . 8.1 t -91.32 -40.63 12.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.162 -0.472 . . . . 60.2 111.114 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -149.05 169.39 20.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.168 -0.469 . . . . 64.24 110.841 -179.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 14.8 p90 -132.29 155.01 49.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.161 -0.472 . . . . 72.25 110.925 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.5 t -102.38 141.78 34.66 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.169 -0.469 . . . . 64.11 111.101 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -52.5 -18.7 1.81 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.449 . . . . 72.14 110.863 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -65.08 -37.07 86.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.21 -0.45 . . . . 74.13 110.9 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.5 mp -142.47 152.11 59.46 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.65 0.738 . . . . 72.52 110.899 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . 0.572 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.9 Cg_endo -69.7 150.94 69.26 Favored 'Trans proline' 0 C--N 1.343 0.244 0 C-N-CA 122.637 2.225 . . . . 73.11 112.362 179.879 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -52.19 -27.84 16.1 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.19 -0.459 . . . . 74.11 110.828 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.572 HG22 ' HB2' ' A' ' 101' ' ' PRO . 2.2 tp -75.22 -38.91 42.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.212 -0.449 . . . . 74.02 111.173 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . 0.775 ' O ' HD22 ' A' ' 108' ' ' LEU . 2.9 m -69.34 -36.84 77.32 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.144 -0.48 . . . . 52.11 111.183 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.762 ' O ' HG13 ' A' ' 109' ' ' VAL . 55.2 t -71.43 -43.44 72.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.159 -0.473 . . . . 71.51 111.105 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.616 ' O ' HG22 ' A' ' 109' ' ' VAL . 24.9 t0 -66.54 -37.57 85.29 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.123 -0.489 . . . . 63.44 110.881 179.878 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . 0.488 ' HG3' ' N ' ' A' ' 108' ' ' LEU . 0.0 OUTLIER -70.36 -33.38 71.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.248 -0.433 . . . . 75.02 110.829 -179.865 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.775 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -66.11 -48.97 69.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.229 -0.441 . . . . 71.04 110.849 -179.891 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.762 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.4 m -55.13 -43.27 69.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.228 -0.442 . . . . 72.31 111.108 179.82 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.494 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 48.2 t -70.7 -34.33 71.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.149 -0.478 . . . . 72.14 110.867 -179.814 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.451 ' CG ' HD21 ' A' ' 189' ' ' LEU . 0.3 OUTLIER -62.56 -33.34 74.74 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.136 -0.483 . . . . 74.35 110.948 179.92 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -95.39 -40.49 9.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.254 -0.43 . . . . 74.32 111.108 179.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.719 ' CD1' HD12 ' A' ' 196' ' ' LEU . 0.4 OUTLIER -65.54 -32.76 74.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.197 -0.456 . . . . 72.0 110.939 -179.999 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 42.4 t30 -65.48 -35.29 80.46 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.187 -0.46 . . . . 72.34 110.84 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . 0.651 ' O ' HD11 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -68.31 -34.52 76.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.188 -0.46 . . . . 54.12 110.813 179.992 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' TRP . . . . . 0.412 ' CG ' HD11 ' A' ' 200' ' ' LEU . 6.0 m95 -66.99 -44.86 79.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.287 -0.415 . . . . 75.23 111.006 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -73.39 -40.74 47.56 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.73 -0.748 . . . . 73.32 112.45 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.431 ' HG2' ' O ' ' A' ' 115' ' ' MET . 3.8 ptpt -60.75 -18.43 54.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.811 0.338 . . . . 72.42 110.92 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.775 ' HG2' HD13 ' A' ' 226' ' ' LEU . 0.1 OUTLIER -96.87 13.46 28.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.167 -0.47 . . . . 75.24 110.884 179.934 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 0.917 HD12 HD12 ' A' ' 122' ' ' LEU . 3.6 pt -147.92 156.0 44.15 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.591 0.71 . . . . 71.34 111.15 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.77 0.27 5.9 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.675 2.25 . . . . 72.21 112.334 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.917 HD12 HD12 ' A' ' 120' ' ' ILE . 12.5 mt -61.18 -157.92 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.229 -0.441 . . . . 73.22 110.909 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.473 ' H ' ' HB3' ' A' ' 122' ' ' LEU . 4.5 t60 -162.66 137.92 6.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.159 -0.473 . . . . 74.12 110.907 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 17.5 m-30 -122.27 142.35 50.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.199 -0.455 . . . . 75.54 110.889 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.758 ' HB3' HG22 ' A' ' 90' ' ' THR . 0.0 OUTLIER -115.26 140.96 48.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.125 -0.489 . . . . 75.14 110.897 -179.888 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.19 141.62 34.02 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.196 -0.456 . . . . 72.22 110.886 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . 0.874 HG11 ' HB2' ' A' ' 132' ' ' ALA . 34.4 m -103.0 139.49 23.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.259 -0.428 . . . . 50.13 111.183 179.8 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -155.13 -29.25 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.165 -0.47 . . . . 74.43 111.077 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -133.22 109.19 9.25 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.146 -0.479 . . . . 71.25 110.881 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.46 -160.69 13.94 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.764 -0.732 . . . . 62.11 112.559 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -101.99 155.77 17.96 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.783 0.325 . . . . 63.25 111.16 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . 0.874 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -112.14 165.41 12.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.193 -0.458 . . . . 51.34 111.068 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -69.5 -54.67 13.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.204 -0.453 . . . . 75.41 110.931 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 27.8 mt -83.8 132.57 31.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.138 -0.483 . . . . 70.51 111.111 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . 0.679 ' SD ' HG22 ' A' ' 94' ' ' VAL . 28.3 mmt -108.81 116.93 32.93 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.158 -0.474 . . . . 72.43 110.932 179.829 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -106.13 88.39 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.251 -0.432 . . . . 70.04 111.124 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . 0.454 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -130.17 169.48 21.11 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.701 -0.762 . . . . 63.34 112.47 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' PHE . . . . . 0.491 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 36.5 m-85 -112.78 145.88 39.8 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.875 0.369 . . . . 74.01 110.874 -179.859 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.491 ' HB2' ' O ' ' A' ' 138' ' ' PHE . . . 173.72 166.44 0.18 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.156 -0.475 . . . . 71.21 111.135 179.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -104.8 172.96 6.51 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.259 -0.428 . . . . 62.21 110.847 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -54.02 -21.53 17.7 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.69 -0.766 . . . . 74.24 112.476 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -67.08 -12.07 58.9 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.812 0.339 . . . . 75.03 111.092 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 2.0 p80 -68.92 -11.6 60.79 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.252 -0.431 . . . . 71.11 110.855 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 117.68 36.57 0.97 Allowed Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.723 -0.751 . . . . 45.51 112.5 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -120.91 139.97 52.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.76 0.315 . . . . 72.14 110.937 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.23 161.76 18.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.451 . . . . 51.25 110.842 -179.7 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 11.9 m-85 64.71 133.52 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.649 0.738 . . . . 73.4 110.91 -179.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.79 134.81 28.82 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.621 2.214 . . . . 74.53 112.336 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -73.59 -33.1 64.45 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.207 -0.451 . . . . 63.52 110.851 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 74.57 -2.5 2.8 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.186 -0.461 . . . . 63.11 110.9 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 49.5 -108.72 0.49 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.706 -0.759 . . . . 71.41 112.531 -179.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.87 139.02 38.83 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.627 2.218 . . . . 75.11 112.325 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 103.21 -153.28 18.09 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.752 -0.737 . . . . 70.32 112.425 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -41.87 155.1 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.898 0.38 . . . . 73.25 110.894 -179.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 155' ' ' THR . . . . . 0.472 HG23 ' HA2' ' A' ' 68' ' ' GLY . 0.2 OUTLIER 75.31 108.78 0.07 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.132 -0.485 . . . . 44.41 111.158 -179.971 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 156' ' ' LEU . . . . . 1.053 HD21 HG21 ' A' ' 186' ' ' ILE . 0.5 OUTLIER -90.53 -53.67 4.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.177 -0.465 . . . . 75.02 110.866 -179.98 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . 0.587 ' HB1' ' O ' ' A' ' 171' ' ' HIS . . . -165.42 148.37 7.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.185 -0.461 . . . . 71.42 111.149 179.823 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 24.0 p-80 -106.13 126.53 52.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.245 -0.434 . . . . 72.02 110.84 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -110.91 160.9 16.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.155 -0.475 . . . . 74.42 111.061 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 13.6 m-85 -111.68 156.96 21.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.215 -0.448 . . . . 75.31 110.913 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 161' ' ' ALA . . . . . 0.69 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -87.79 164.09 35.62 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 121.586 0.708 . . . . 61.04 111.155 179.878 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 162' ' ' PRO . . . . . 0.69 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 54.5 Cg_endo -69.71 81.8 0.78 Allowed 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.755 2.304 . . . . 74.44 112.37 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -146.7 128.8 3.11 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.727 -0.749 . . . . 61.41 112.448 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 63.9 -172.36 0.17 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.8 0.333 . . . . 73.1 111.174 -179.864 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -87.41 -41.51 6.49 Favored Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.736 -0.745 . . . . 74.03 112.409 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 166' ' ' LEU . . . . . 0.554 HD23 ' O ' ' A' ' 166' ' ' LEU . 8.8 tt -71.4 -32.78 68.82 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.84 0.352 . . . . 65.12 110.85 -179.811 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -79.35 172.45 55.11 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.665 -0.778 . . . . 43.43 112.467 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 78.03 23.08 67.13 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.679 -0.772 . . . . 74.31 112.479 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 95.2 m-20 -97.23 167.49 11.0 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.892 0.377 . . . . 63.41 110.837 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.91 130.34 56.15 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.151 -0.477 . . . . 74.21 111.096 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 171' ' ' HIS . . . . . 0.587 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 16.2 m170 -127.24 132.91 50.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.221 -0.445 . . . . 72.53 110.791 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 41.9 m-85 -116.86 139.59 50.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.171 -0.468 . . . . 71.44 110.904 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 65.4 t0 -69.38 97.18 0.95 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.151 -0.477 . . . . 74.11 110.861 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.97 -16.66 7.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.166 -0.47 . . . . 72.25 110.85 -179.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -79.48 -19.66 49.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.14 -0.482 . . . . 73.32 110.811 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -78.81 -174.87 4.17 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.237 -0.438 . . . . 63.2 110.932 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 177' ' ' ARG . . . . . 0.455 ' HG3' ' HA3' ' A' ' 185' ' ' GLY . 1.4 ptm180 -116.54 116.74 28.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.222 -0.444 . . . . 63.14 110.831 -179.874 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 178' ' ' TRP . . . . . 0.4 ' CE3' ' HB ' ' A' ' 186' ' ' ILE . 21.4 m95 -117.11 148.14 41.8 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.142 -0.481 . . . . 72.31 110.856 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 179' ' ' THR . . . . . 0.497 HG21 ' OG ' ' A' ' 182' ' ' SER . 7.5 t 179.16 163.65 0.87 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.206 -0.452 . . . . 74.13 111.167 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -128.35 -68.26 0.77 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.171 -0.468 . . . . 45.33 110.87 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -60.34 -15.16 37.14 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.672 -0.775 . . . . 62.41 112.536 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 182' ' ' SER . . . . . 0.497 ' OG ' HG21 ' A' ' 179' ' ' THR . 0.3 OUTLIER -97.51 -24.33 15.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.865 0.364 . . . . 64.5 110.862 -179.773 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 66.7 m 37.84 56.42 1.56 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.158 -0.474 . . . . 64.12 110.821 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 1.3 tp -116.9 -33.2 4.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.102 -0.499 . . . . 74.2 110.867 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 185' ' ' GLY . . . . . 0.455 ' HA3' ' HG3' ' A' ' 177' ' ' ARG . . . -114.37 -142.25 7.93 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.756 -0.735 . . . . 73.01 112.52 179.912 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 186' ' ' ILE . . . . . 1.053 HG21 HD21 ' A' ' 156' ' ' LEU . 11.1 mm -79.07 97.71 2.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.81 0.338 . . . . 73.22 111.125 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -45.53 117.21 1.36 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.199 -0.455 . . . . 71.31 110.815 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 188' ' ' PHE . . . . . 0.684 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.7 t80 -54.09 -36.91 63.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.106 -0.497 . . . . 75.45 110.868 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . 0.451 HD21 ' CG ' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -67.21 -47.33 71.2 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.135 -0.484 . . . . 52.02 110.886 -179.94 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -68.93 -41.43 78.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.177 -0.465 . . . . 74.22 110.953 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 191' ' ' ALA . . . . . 0.61 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -69.11 -35.19 76.16 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.138 -0.483 . . . . 50.03 111.062 179.873 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 192' ' ' ALA . . . . . 0.687 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -57.26 -44.05 83.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.225 -0.443 . . . . 52.11 111.034 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.08 -43.49 87.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.226 -0.443 . . . . 72.43 111.169 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 17.6 t-160 -73.12 -42.06 63.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.206 -0.452 . . . . 71.44 110.82 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -70.12 -47.53 61.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.206 -0.452 . . . . 71.01 111.114 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 196' ' ' LEU . . . . . 0.719 HD12 ' CD1' ' A' ' 113' ' ' LEU . 4.5 mm? -64.54 -37.94 89.3 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.192 -0.458 . . . . 74.51 110.901 -179.947 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -60.97 -27.29 66.82 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.757 -0.735 . . . . 52.23 112.501 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 198' ' ' HIS . . . . . 0.625 ' CD2' HG21 ' A' ' 69' ' ' VAL . 6.5 m-70 -67.98 -35.69 78.76 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.732 0.301 . . . . 75.21 110.799 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.96 -20.88 65.1 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.282 -0.417 . . . . 71.13 110.837 -179.764 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 200' ' ' LEU . . . . . 0.473 ' HB2' ' HG2' ' A' ' 202' ' ' MET . 0.5 OUTLIER -88.02 -0.04 56.53 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.175 -0.466 . . . . 64.13 110.926 -179.992 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 83.97 5.53 87.65 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.723 -0.751 . . . . 50.41 112.533 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 202' ' ' MET . . . . . 0.602 ' SD ' HD12 ' A' ' 234' ' ' ILE . 97.7 mmm -62.73 173.11 1.39 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.781 0.324 . . . . 63.21 110.907 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -137.16 169.19 24.08 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.779 -0.724 . . . . 64.44 112.535 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 20.5 m-70 -66.84 151.49 47.41 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.768 0.318 . . . . 74.32 110.857 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -118.99 146.06 45.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.222 -0.445 . . . . 53.34 110.835 -179.771 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 206' ' ' SER . . . . . 0.404 ' HB3' ' HA2' ' A' ' 47' ' ' GLY . 3.6 m -87.86 -4.19 58.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.104 -0.498 . . . . 72.22 110.899 -179.847 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 207' ' ' ASP . . . . . 0.419 ' O ' ' CD1' ' A' ' 213' ' ' TYR . 0.1 OUTLIER -71.33 142.87 87.36 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.571 0.701 . . . . 65.11 110.874 179.916 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.68 -29.96 23.43 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.658 2.238 . . . . 74.53 112.405 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 3.1 p-10 -105.57 25.36 10.85 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.214 -0.448 . . . . 63.52 110.845 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 210' ' ' ALA . . . . . 0.47 ' O ' ' HB2' ' A' ' 213' ' ' TYR . . . -87.31 146.3 25.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.22 -0.445 . . . . 62.23 111.096 179.814 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 211' ' ' VAL . . . . . 0.478 HG12 ' HG3' ' A' ' 212' ' ' MET . 0.4 OUTLIER -73.59 -26.61 22.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.187 -0.46 . . . . 62.04 111.145 179.974 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 212' ' ' MET . . . . . 0.478 ' HG3' HG12 ' A' ' 211' ' ' VAL . 0.0 OUTLIER -87.86 9.87 20.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.12 -0.491 . . . . 75.22 110.87 179.932 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 213' ' ' TYR . . . . . 0.47 ' HB2' ' O ' ' A' ' 210' ' ' ALA . 0.4 OUTLIER -54.93 120.16 27.01 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.676 0.751 . . . . 73.43 110.88 -179.851 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 214' ' ' PRO . . . . . 0.464 ' HA ' ' HG3' ' A' ' 66' ' ' ARG . 53.4 Cg_endo -69.75 -17.97 37.33 Favored 'Trans proline' 0 C--N 1.342 0.184 0 C-N-CA 122.604 2.203 . . . . 63.01 112.374 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -84.26 -2.4 56.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.18 -0.464 . . . . 74.24 111.2 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 1.5 t80 . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.173 -0.467 . . . . 74.14 110.954 -179.88 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.15 0 CA-C-O 120.87 0.367 . . . . 65.01 110.915 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -143.8 160.55 40.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.455 . . . . 64.24 110.937 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 226' ' ' LEU . . . . . 0.775 HD13 ' HG2' ' A' ' 119' ' ' GLU . 6.6 mt -63.81 149.53 46.71 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.227 -0.442 . . . . 53.44 110.885 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 227' ' ' SER . . . . . . . . . . . . . 1.3 t -86.68 152.01 22.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.208 -0.451 . . . . 74.21 110.895 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 10.7 tt0 -64.4 -66.02 0.6 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.164 -0.471 . . . . 74.54 110.927 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 229' ' ' ASP . . . . . 0.439 ' O ' ' HG3' ' A' ' 232' ' ' LYS . 0.2 OUTLIER -56.08 -25.58 45.91 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.185 -0.462 . . . . 72.22 110.844 179.979 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 230' ' ' ASP . . . . . 0.401 ' OD2' HG12 ' A' ' 211' ' ' VAL . 0.5 OUTLIER -69.69 -48.7 58.74 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.205 -0.452 . . . . 74.23 110.855 -179.969 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 231' ' ' ILE . . . . . 0.67 HD11 ' HB3' ' A' ' 226' ' ' LEU . 9.2 mt -68.83 -41.58 82.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.152 -0.476 . . . . 73.41 111.12 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 232' ' ' LYS . . . . . 0.439 ' HG3' ' O ' ' A' ' 229' ' ' ASP . 0.0 OUTLIER -56.67 -32.06 65.03 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.167 -0.47 . . . . 65.42 110.89 179.855 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 233' ' ' GLY . . . . . 0.408 ' N ' ' HG3' ' A' ' 232' ' ' LYS . . . -64.95 -49.94 60.45 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.731 -0.747 . . . . 63.43 112.464 179.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 234' ' ' ILE . . . . . 0.602 HD12 ' SD ' ' A' ' 202' ' ' MET . 7.9 tt -72.84 -30.56 33.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.776 0.322 . . . . 71.54 111.173 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 13.0 mt-30 -69.72 -24.31 63.54 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.13 -0.486 . . . . 70.33 110.908 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 236' ' ' LYS . . . . . 0.449 ' HE2' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -73.81 -26.68 60.74 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.148 -0.478 . . . . 51.21 110.909 179.937 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 237' ' ' LEU . . . . . 0.679 HD22 ' HD2' ' A' ' 83' ' ' LYS . 10.3 tt -97.42 -36.17 10.44 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.223 -0.444 . . . . 75.41 110.931 179.911 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 238' ' ' TYR . . . . . 0.447 ' CE2' HD11 ' A' ' 122' ' ' LEU . 54.2 m-85 -92.12 -5.28 53.01 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.181 -0.463 . . . . 51.24 110.877 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.296 0 C-N-CA 120.778 -0.725 . . . . 32.22 112.435 -179.97 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 30.8 t-105 . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.726 0.298 . . . . 71.22 110.895 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -68.49 -35.2 77.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.292 -0.413 . . . . 72.51 110.911 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -62.92 -36.52 83.65 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.151 -0.477 . . . . 61.24 110.949 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.502 ' CB ' HD11 ' A' ' 59' ' ' ILE . . . -57.01 -42.95 81.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.169 -0.469 . . . . 54.34 111.075 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 11.1 tt0 -70.45 -42.98 70.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.259 -0.428 . . . . 73.12 110.911 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -65.8 -31.53 72.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.141 -0.482 . . . . 72.4 110.88 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -62.26 -36.1 80.99 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.185 -0.461 . . . . 75.11 110.873 -179.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.712 HD21 ' HG3' ' A' ' 42' ' ' MET . 4.0 mt -70.43 -21.07 62.86 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.127 -0.488 . . . . 72.51 110.935 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.411 ' HG2' ' N ' ' A' ' 21' ' ' ARG . 4.6 ptmt -74.59 -31.21 61.97 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.216 -0.447 . . . . 74.41 110.909 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.411 ' N ' ' HG2' ' A' ' 20' ' ' LYS . 4.4 ptp180 -86.65 -27.45 23.78 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.227 -0.442 . . . . 74.05 110.89 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.414 ' O ' ' HA ' ' A' ' 70' ' ' PRO . 1.7 m-85 -60.78 -13.06 12.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 74.31 110.835 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.131 -0.486 . . . . 72.55 110.959 -179.899 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.581 ' CD2' HD22 ' A' ' 39' ' ' LEU . 1.3 tt . . . . . 0 N--CA 1.46 0.049 0 CA-C-O 120.755 0.312 . . . . 72.52 110.887 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.72 -48.37 74.9 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.191 -0.458 . . . . 73.13 110.92 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.28 -48.52 76.45 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.128 -0.487 . . . . 63.32 111.136 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.499 ' HE3' HD13 ' A' ' 19' ' ' LEU . 0.5 OUTLIER -67.9 -38.64 83.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.234 -0.439 . . . . 72.32 110.856 179.978 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.599 HD21 ' HB2' ' A' ' 54' ' ' LEU . 1.1 mp -54.58 -36.59 64.56 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.242 -0.435 . . . . 72.11 110.859 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.35 -45.68 87.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.173 -0.467 . . . . 62.43 110.907 179.836 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -69.7 -34.81 74.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.211 -0.45 . . . . 75.11 110.917 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.712 ' HG3' HD21 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -68.51 -47.04 68.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.107 -0.497 . . . . 63.43 110.909 179.912 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.55 ' CG ' HD11 ' A' ' 48' ' ' LEU . 3.2 mt-30 -58.57 -44.24 89.7 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.246 -0.434 . . . . 74.45 110.869 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.5 mmpt? -68.26 -29.99 68.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.175 -0.466 . . . . 71.43 110.904 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 30.0 t80 -69.98 -35.39 74.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.182 -0.463 . . . . 73.32 110.903 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.495 ' CB ' HD23 ' A' ' 48' ' ' LEU . 5.3 m-85 -79.57 -29.77 41.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.162 -0.472 . . . . 70.43 110.825 -179.891 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.45 ' HA2' ' HB2' ' A' ' 206' ' ' SER . . . 104.74 -10.56 49.1 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.694 -0.765 . . . . 64.34 112.536 -179.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.55 HD11 ' CG ' ' A' ' 43' ' ' GLN . 0.8 OUTLIER -67.27 139.34 94.8 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.683 0.754 . . . . 64.11 110.865 -179.86 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.71 -52.69 0.31 Allowed 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.705 2.27 . . . . 74.5 112.351 179.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.446 ' O ' HD12 ' A' ' 48' ' ' LEU . 0.6 OUTLIER -49.24 108.1 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.212 -0.449 . . . . 71.22 111.133 179.939 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 1.5 t -107.01 163.68 12.77 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.198 -0.456 . . . . 73.25 111.131 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 60.82 17.02 49.06 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.747 -0.74 . . . . 64.24 112.465 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -114.13 161.13 18.16 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.852 0.358 . . . . 75.23 110.899 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.599 ' HB2' HD21 ' A' ' 39' ' ' LEU . 55.5 tp -173.29 85.1 0.05 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.23 -0.441 . . . . 73.4 110.929 -179.928 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 172.44 -27.1 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.241 -0.436 . . . . 44.35 110.917 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 2.5 p -88.8 -97.14 0.09 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.224 -0.444 . . . . 75.25 110.875 -179.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.6 tpt180 -85.04 -32.38 22.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.146 -0.479 . . . . 61.22 110.89 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 69.1 t -60.14 -45.47 95.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.225 -0.443 . . . . 70.12 111.166 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.502 HD11 ' CB ' ' A' ' 15' ' ' ALA . 0.8 OUTLIER -69.73 -31.32 48.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.168 -0.469 . . . . 74.43 111.113 179.881 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -59.36 -34.15 72.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.227 -0.442 . . . . 73.45 110.917 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.641 HG21 HG22 ' A' ' 215' ' ' THR . 0.2 OUTLIER -78.52 -30.03 15.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.108 -0.496 . . . . 74.52 111.121 179.977 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 5.2 mtt -63.11 -38.23 90.36 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.117 -0.492 . . . . 74.01 110.908 179.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -82.27 -23.14 35.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.147 -0.479 . . . . 42.22 110.927 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 27.5 mttm -85.34 140.77 36.5 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.638 0.732 . . . . 65.34 110.837 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.82 157.69 59.41 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.632 2.221 . . . . 72.11 112.361 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.413 ' HG3' ' HA ' ' A' ' 214' ' ' PRO . 34.5 ttp180 -155.18 -82.24 0.07 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.255 -0.429 . . . . 71.51 110.825 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -145.14 156.26 43.78 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.229 -0.441 . . . . 55.3 110.847 -179.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.637 ' HA2' HG23 ' A' ' 155' ' ' THR . . . -101.31 17.55 55.43 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.814 -0.708 . . . . 64.23 112.571 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.807 HG12 ' HD2' ' A' ' 70' ' ' PRO . 0.0 OUTLIER -109.19 143.49 27.79 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 121.732 0.777 . . . . 74.23 111.101 -179.95 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . 0.807 ' HD2' HG12 ' A' ' 69' ' ' VAL . 53.2 Cg_endo -69.82 163.76 37.1 Favored 'Trans proline' 0 C--N 1.342 0.237 0 C-N-CA 122.713 2.275 . . . . 63.44 112.274 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 54.6 m-20 -112.53 33.79 4.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.152 -0.476 . . . . 74.45 110.822 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 1.8 m . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.224 -0.443 . . . . 53.43 111.229 179.956 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo . . . . . 0 N--CA 1.465 -0.171 0 CA-C-O 120.866 0.277 . . . . 71.11 112.382 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.723 ' CG ' HD22 ' A' ' 237' ' ' LEU . 0.2 OUTLIER -119.8 -168.07 1.54 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.226 -0.443 . . . . 64.45 110.903 179.918 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 58.1 m95 -76.14 140.01 41.56 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.205 -0.452 . . . . 73.31 110.887 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 11.4 t -114.67 -23.64 9.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.224 -0.443 . . . . 65.3 111.147 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -55.05 150.29 10.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.25 -0.432 . . . . 70.34 110.84 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 35.9 mmtt -64.86 -29.81 70.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.105 -0.498 . . . . 71.12 110.898 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.552 HG23 ' CD2' ' A' ' 123' ' ' HIS . 0.4 OUTLIER -148.63 138.15 15.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 74.14 111.147 179.862 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 85.1 t -114.91 130.45 69.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.454 . . . . 72.25 111.118 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.682 HG22 ' HB3' ' A' ' 125' ' ' ARG . 28.6 p -115.91 168.09 10.37 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.155 -0.475 . . . . 71.01 111.125 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 4.2 p90 -146.48 146.78 30.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.163 -0.471 . . . . 70.51 110.888 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 4.4 ttt180 -149.0 138.11 21.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.113 -0.494 . . . . 71.25 110.884 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.409 HD11 ' HA ' ' A' ' 106' ' ' ASP . 10.3 mm -76.48 135.3 27.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.223 -0.444 . . . . 72.4 111.147 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.485 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 17.9 t -91.14 -40.36 12.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.184 -0.462 . . . . 60.2 111.143 179.819 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 25.9 p -142.22 169.49 17.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.127 -0.488 . . . . 64.24 110.855 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 5.2 p90 -115.14 150.74 35.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.124 -0.489 . . . . 72.25 110.889 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.545 ' OG1' HG21 ' A' ' 105' ' ' VAL . 0.2 OUTLIER -83.05 141.05 32.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.083 -0.508 . . . . 64.11 111.139 -179.996 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 3.7 mtt-85 -73.0 -8.28 55.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.215 -0.448 . . . . 72.14 110.908 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -96.53 -26.0 15.43 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.148 -0.478 . . . . 74.13 110.893 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.663 HD21 ' HA ' ' A' ' 179' ' ' THR . 0.8 OUTLIER -135.91 153.51 77.11 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.676 0.75 . . . . 72.52 110.882 -179.904 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . 0.608 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.5 Cg_endo -69.76 150.91 68.82 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.684 2.256 . . . . 73.11 112.309 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 6.4 t-160 -53.34 -25.55 15.62 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.102 -0.499 . . . . 74.11 110.852 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.608 HG22 ' HB2' ' A' ' 101' ' ' PRO . 13.2 tt -76.54 -38.37 31.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.239 -0.437 . . . . 74.02 111.13 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . 0.624 ' O ' HD22 ' A' ' 108' ' ' LEU . 2.9 m -69.14 -40.59 78.15 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.193 -0.458 . . . . 52.11 111.161 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.735 ' O ' HG13 ' A' ' 109' ' ' VAL . 55.9 t -72.92 -46.06 53.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 71.51 111.146 179.869 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.653 ' O ' HG22 ' A' ' 109' ' ' VAL . 60.5 t0 -61.5 -44.9 96.24 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.142 -0.481 . . . . 63.44 110.94 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -70.03 -33.41 71.95 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.161 -0.472 . . . . 75.02 110.87 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.624 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -60.26 -49.27 78.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.451 . . . . 71.04 110.926 -179.94 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.735 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.5 m -55.3 -42.05 64.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.206 -0.452 . . . . 72.31 111.18 179.79 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.469 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 43.2 t -70.22 -33.45 71.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.138 -0.483 . . . . 72.14 110.804 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.458 ' HB3' HD21 ' A' ' 189' ' ' LEU . 0.8 OUTLIER -61.46 -33.05 73.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.15 -0.477 . . . . 74.35 110.853 -179.984 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.75 -40.15 9.11 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.262 -0.426 . . . . 74.32 111.135 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.799 HD12 HD12 ' A' ' 196' ' ' LEU . 0.3 OUTLIER -63.98 -33.63 76.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.216 -0.447 . . . . 72.0 110.891 -179.965 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -65.6 -35.65 81.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.205 -0.452 . . . . 72.34 110.925 179.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . 0.725 ' HB3' HD23 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -66.3 -31.95 73.07 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.13 -0.487 . . . . 54.12 110.913 179.892 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' TRP . . . . . 0.538 ' CZ3' HD11 ' A' ' 226' ' ' LEU . 8.7 m95 -73.98 -45.22 51.45 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.27 -0.423 . . . . 75.23 110.861 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -66.05 -44.75 90.8 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.775 -0.726 . . . . 73.32 112.464 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.471 ' HG3' ' O ' ' A' ' 115' ' ' MET . 0.0 OUTLIER -61.97 -17.38 56.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.702 0.287 . . . . 72.42 110.865 -179.943 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.459 ' HG3' ' HG ' ' A' ' 226' ' ' LEU . 34.5 mm-40 -91.32 2.26 56.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.244 -0.435 . . . . 75.24 110.847 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 1.023 HD12 HD12 ' A' ' 122' ' ' LEU . 6.0 pt -139.29 150.61 64.9 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.659 0.743 . . . . 71.34 111.094 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 6.35 1.34 Allowed 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.699 2.266 . . . . 72.21 112.43 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 1.023 HD12 HD12 ' A' ' 120' ' ' ILE . 11.3 mt -60.96 -161.11 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.129 -0.487 . . . . 73.22 110.986 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.552 ' CD2' HG23 ' A' ' 88' ' ' VAL . 3.5 t60 -151.03 122.48 7.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.24 -0.436 . . . . 74.12 110.858 179.893 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 10.6 m-30 -109.51 148.41 31.25 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.173 -0.467 . . . . 75.54 110.899 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.682 ' HB3' HG22 ' A' ' 90' ' ' THR . 0.0 OUTLIER -133.14 141.9 48.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.117 -0.492 . . . . 75.14 110.848 -179.907 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.8 147.58 30.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.152 -0.476 . . . . 72.22 110.934 -179.977 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . 1.02 HG11 ' HB2' ' A' ' 132' ' ' ALA . 30.1 m -103.25 126.29 57.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.26 -0.427 . . . . 50.13 111.162 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.598 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -142.52 -9.89 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.205 -0.452 . . . . 74.43 111.154 179.947 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' TRP . . . . . 0.598 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -155.75 109.08 2.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.116 -0.493 . . . . 71.25 110.87 -179.972 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.15 -159.96 14.38 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.748 -0.739 . . . . 62.11 112.502 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.8 156.21 17.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.842 0.354 . . . . 63.25 111.116 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . 1.02 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -111.83 165.1 12.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.191 -0.459 . . . . 51.34 111.081 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -67.66 -55.8 11.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.231 -0.441 . . . . 75.41 110.885 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 31.6 mt -92.4 133.04 35.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.223 -0.444 . . . . 70.51 111.167 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . 0.485 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 14.7 mmm -111.23 124.48 52.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.226 -0.443 . . . . 72.43 110.875 179.821 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -107.06 91.22 1.7 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.147 -0.479 . . . . 70.04 111.107 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . 0.423 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -132.38 164.25 23.9 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.736 -0.745 . . . . 63.34 112.507 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' PHE . . . . . 0.469 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 46.2 m-85 -105.67 144.28 32.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.793 0.33 . . . . 74.01 110.86 -179.819 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.469 ' HB2' ' O ' ' A' ' 138' ' ' PHE . . . 175.15 167.03 0.3 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.143 -0.48 . . . . 71.21 111.033 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 20.8 mtm105 -104.36 173.62 6.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.192 -0.458 . . . . 62.21 110.88 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -56.06 -17.1 15.47 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.734 -0.746 . . . . 74.24 112.547 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -83.5 3.48 32.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.812 0.339 . . . . 75.03 111.118 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 7.2 p80 -69.85 -30.39 67.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.236 -0.438 . . . . 71.11 110.848 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 144.51 41.03 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.747 -0.74 . . . . 45.51 112.462 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 55.4 p-10 -146.64 162.22 38.91 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.839 0.352 . . . . 72.14 110.89 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 51.0 m -81.65 -179.9 7.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.151 -0.477 . . . . 51.25 110.888 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 64.65 123.68 0.02 OUTLIER Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.684 0.754 . . . . 73.4 110.937 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.83 146.19 58.98 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.717 2.278 . . . . 74.53 112.344 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 149' ' ' PHE . . . . . 0.411 ' CE1' ' HB2' ' A' ' 173' ' ' ASP . 0.1 OUTLIER -90.81 -33.19 15.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.21 -0.45 . . . . 63.52 110.882 -179.952 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 73.87 -1.76 2.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.111 -0.495 . . . . 63.11 110.847 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 51.88 -111.83 1.64 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.762 -0.732 . . . . 71.41 112.459 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.82 139.59 40.39 Favored 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.68 2.254 . . . . 75.11 112.333 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 103.14 -153.14 18.12 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.757 -0.735 . . . . 70.32 112.452 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 154' ' ' ASN . . . . . 0.415 ' O ' ' CB ' ' A' ' 155' ' ' THR . 4.6 p30 -40.81 152.04 0.05 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.913 0.387 . . . . 73.25 110.891 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 155' ' ' THR . . . . . 0.637 HG23 ' HA2' ' A' ' 68' ' ' GLY . 1.4 m 78.34 110.81 0.07 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.189 -0.46 . . . . 44.41 111.112 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 156' ' ' LEU . . . . . 1.053 HD21 HG21 ' A' ' 186' ' ' ILE . 0.7 OUTLIER -92.25 -52.57 4.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.223 -0.444 . . . . 75.02 110.892 179.959 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . 0.556 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -166.81 148.12 6.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.246 -0.434 . . . . 71.42 111.087 179.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 24.6 p-80 -106.46 125.58 51.17 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.254 -0.43 . . . . 72.02 110.888 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -111.0 154.82 23.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 74.42 111.079 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 18.1 m-85 -104.21 150.09 24.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.183 -0.462 . . . . 75.31 110.842 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 161' ' ' ALA . . . . . 0.652 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -77.67 162.64 67.47 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 121.573 0.701 . . . . 61.04 111.122 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 162' ' ' PRO . . . . . 0.652 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 54.5 Cg_endo -69.68 77.51 1.04 Allowed 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.658 2.239 . . . . 74.44 112.369 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -132.56 124.71 3.94 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.736 -0.745 . . . . 61.41 112.441 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 9.6 p 50.95 -170.72 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.856 0.36 . . . . 73.1 111.172 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -76.1 -57.51 4.0 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.775 -0.726 . . . . 74.03 112.479 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 166' ' ' LEU . . . . . 0.473 HD23 ' O ' ' A' ' 166' ' ' LEU . 7.7 tt -54.37 -39.69 67.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.853 0.358 . . . . 65.12 110.927 -179.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -81.01 153.63 34.43 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.693 -0.765 . . . . 43.43 112.446 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 95.12 23.02 21.19 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.747 -0.739 . . . . 74.31 112.537 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 82.4 m-20 -92.14 173.29 7.9 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.825 0.345 . . . . 63.41 110.88 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -118.2 130.63 56.2 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.166 -0.47 . . . . 74.21 111.114 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 171' ' ' HIS . . . . . 0.547 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 16.8 m170 -128.66 132.58 48.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.207 -0.451 . . . . 72.53 110.924 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -116.35 140.16 49.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.253 -0.431 . . . . 71.44 110.902 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 173' ' ' ASP . . . . . 0.411 ' HB2' ' CE1' ' A' ' 149' ' ' PHE . 68.0 t0 -69.22 96.85 0.87 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.117 -0.492 . . . . 74.11 110.778 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 2.6 pp20? -56.42 -17.95 9.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.222 -0.445 . . . . 72.25 110.886 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -79.55 -20.46 47.04 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.117 -0.492 . . . . 73.32 110.944 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 30.0 mm-40 -77.88 -172.4 2.66 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.16 -0.473 . . . . 63.2 110.926 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 177' ' ' ARG . . . . . 0.404 ' HG3' ' HA3' ' A' ' 185' ' ' GLY . 20.2 ptt180 -115.03 115.28 26.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.172 -0.467 . . . . 63.14 110.841 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 53.6 m95 -116.95 142.9 46.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.155 -0.475 . . . . 72.31 110.898 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 179' ' ' THR . . . . . 0.663 ' HA ' HD21 ' A' ' 100' ' ' LEU . 12.2 t -178.16 163.61 1.71 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.252 -0.431 . . . . 74.13 111.156 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -125.28 -68.9 0.82 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.209 -0.45 . . . . 45.33 110.896 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -63.99 -12.99 51.35 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.762 -0.732 . . . . 62.41 112.515 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 182' ' ' SER . . . . . 0.507 ' HB3' HG21 ' A' ' 179' ' ' THR . 0.4 OUTLIER -93.34 -24.41 18.12 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.852 0.358 . . . . 64.5 110.81 -179.712 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 86.9 p 38.27 42.96 0.56 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.185 -0.461 . . . . 64.12 110.839 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 2.3 tt -106.92 -33.42 7.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.126 -0.488 . . . . 74.2 110.913 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 185' ' ' GLY . . . . . 0.404 ' HA3' ' HG3' ' A' ' 177' ' ' ARG . . . -113.11 -145.46 9.38 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.69 -0.767 . . . . 73.01 112.428 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 186' ' ' ILE . . . . . 1.053 HG21 HD21 ' A' ' 156' ' ' LEU . 10.6 mm -78.93 97.77 2.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.875 0.369 . . . . 73.22 111.11 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -44.23 115.21 0.8 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.178 -0.464 . . . . 71.31 110.85 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 188' ' ' PHE . . . . . 0.552 ' HD2' ' HB3' ' A' ' 108' ' ' LEU . 1.4 t80 -53.88 -33.64 57.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.199 -0.455 . . . . 75.45 110.912 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . 0.574 HD12 ' HE2' ' A' ' 224' ' ' PHE . 0.2 OUTLIER -67.07 -48.25 68.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.098 -0.501 . . . . 52.02 110.922 -179.997 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.23 -39.77 74.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.151 -0.477 . . . . 74.22 110.938 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 191' ' ' ALA . . . . . 0.553 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -69.87 -34.9 74.18 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.171 -0.468 . . . . 50.03 111.047 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 192' ' ' ALA . . . . . 0.693 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -56.38 -44.61 80.36 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.247 -0.433 . . . . 52.11 111.1 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.77 -43.62 90.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 72.43 111.182 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 15.7 t-160 -72.9 -38.0 67.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.218 -0.446 . . . . 71.44 110.872 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -74.63 -47.38 32.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.201 -0.454 . . . . 71.01 111.117 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 196' ' ' LEU . . . . . 0.799 HD12 HD12 ' A' ' 113' ' ' LEU . 4.6 mm? -63.08 -45.78 90.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.259 -0.428 . . . . 74.51 110.906 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -54.86 -29.47 50.67 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.731 -0.747 . . . . 52.23 112.506 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 198' ' ' HIS . . . . . 0.461 ' CD2' HG21 ' A' ' 69' ' ' VAL . 6.4 m-70 -66.6 -35.89 81.28 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.887 0.375 . . . . 75.21 110.889 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 13.0 t -68.05 -21.28 65.01 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.171 -0.468 . . . . 71.13 110.877 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -89.55 -7.45 54.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.141 -0.481 . . . . 64.13 110.881 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 89.73 9.58 66.12 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.715 -0.755 . . . . 50.41 112.459 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 202' ' ' MET . . . . . . . . . . . . . 18.1 tpp -72.85 135.08 45.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.797 0.332 . . . . 63.21 110.92 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -101.34 159.11 18.71 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.799 -0.715 . . . . 64.44 112.453 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 11.2 m170 -54.77 163.04 1.04 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.736 0.303 . . . . 74.32 110.895 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -124.39 153.93 41.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.255 -0.429 . . . . 53.34 110.912 -179.878 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 206' ' ' SER . . . . . 0.45 ' HB2' ' HA2' ' A' ' 47' ' ' GLY . 7.9 p -88.2 -4.68 58.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.09 -0.504 . . . . 72.22 110.87 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.55 137.51 83.39 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.535 0.683 . . . . 65.11 110.882 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.74 -7.38 20.9 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.628 2.218 . . . . 74.53 112.383 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -125.48 29.32 6.04 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.132 -0.485 . . . . 63.52 110.867 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 210' ' ' ALA . . . . . 0.478 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.24 145.38 26.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.183 -0.462 . . . . 62.23 111.14 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -73.47 -25.14 20.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.218 -0.446 . . . . 62.04 111.143 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 35.3 mmm -95.24 9.52 39.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.451 . . . . 75.22 110.826 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 213' ' ' TYR . . . . . 0.434 ' HB2' ' O ' ' A' ' 210' ' ' ALA . 0.2 OUTLIER -55.59 126.7 64.65 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-O 121.633 0.73 . . . . 73.43 110.926 -179.895 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 214' ' ' PRO . . . . . 0.427 ' HD2' ' CD1' ' A' ' 213' ' ' TYR . 54.1 Cg_endo -69.69 -18.54 37.3 Favored 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.69 2.26 . . . . 63.01 112.313 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 215' ' ' THR . . . . . 0.641 HG22 HG21 ' A' ' 61' ' ' ILE . 18.6 p -99.85 66.97 1.42 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.213 -0.449 . . . . 74.24 111.052 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 116.222 -0.445 . . . . 74.14 110.877 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 224' ' ' PHE . . . . . 0.574 ' HE2' HD12 ' A' ' 189' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.969 0.414 . . . . 65.01 110.855 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.7 -170.8 3.39 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.124 -0.489 . . . . 64.24 110.931 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 226' ' ' LEU . . . . . 0.725 HD23 ' HB3' ' A' ' 115' ' ' MET . 0.9 OUTLIER -59.18 148.93 29.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.258 -0.428 . . . . 53.44 110.922 179.885 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 227' ' ' SER . . . . . 0.478 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 1.9 t -86.73 156.31 20.0 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.14 -0.482 . . . . 74.21 110.889 -179.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.71 -63.5 1.24 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.178 -0.464 . . . . 74.54 110.948 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 49.3 t0 -55.66 -27.47 50.16 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.233 -0.44 . . . . 72.22 110.878 179.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.77 -48.24 59.98 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.196 -0.456 . . . . 74.23 110.841 -179.977 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 231' ' ' ILE . . . . . 0.528 HD11 ' HB3' ' A' ' 226' ' ' LEU . 12.8 mt -68.32 -43.82 84.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.237 -0.438 . . . . 73.41 111.203 179.924 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.71 -32.45 73.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.074 -0.512 . . . . 65.42 110.867 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -62.78 -49.8 69.59 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.795 -0.717 . . . . 63.43 112.513 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 234' ' ' ILE . . . . . 0.529 ' CD1' HG21 ' A' ' 120' ' ' ILE . 18.9 tt -73.13 -32.27 38.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-O 120.803 0.335 . . . . 71.54 111.161 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -67.15 -29.19 68.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.112 -0.495 . . . . 70.33 110.86 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 236' ' ' LYS . . . . . 0.45 ' HE3' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.49 -24.21 58.98 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.2 -0.455 . . . . 51.21 110.903 179.935 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 237' ' ' LEU . . . . . 0.723 HD22 ' CG ' ' A' ' 83' ' ' LYS . 1.7 tt -97.58 -29.48 13.42 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.241 -0.436 . . . . 75.41 110.949 179.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 238' ' ' TYR . . . . . 0.463 ' OH ' HD11 ' A' ' 122' ' ' LEU . 3.9 m-85 -91.91 -35.72 13.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.175 -0.466 . . . . 51.24 110.851 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.255 0 C-N-CA 120.786 -0.721 . . . . 32.22 112.435 -179.971 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.447 ' CE2' HD23 ' A' ' 54' ' ' LEU . 15.8 t-105 . . . . . 0 C--O 1.23 0.077 0 CA-C-O 120.741 0.305 . . . . 71.22 110.926 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -73.17 -36.49 66.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.229 -0.442 . . . . 72.51 110.947 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -63.77 -36.78 85.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.106 -0.497 . . . . 61.24 110.922 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.657 ' HB1' ' HE3' ' A' ' 62' ' ' MET . . . -63.6 -37.33 86.91 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.139 -0.482 . . . . 54.34 111.124 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.672 ' CD ' HD12 ' A' ' 35' ' ' LEU . 0.1 OUTLIER -67.65 -43.02 81.27 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.238 -0.437 . . . . 73.12 110.861 -179.925 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -73.94 -32.42 63.49 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.201 -0.454 . . . . 72.4 110.891 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 3.5 m-30 -70.65 -36.28 73.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.134 -0.485 . . . . 75.11 110.906 -179.795 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.679 HD13 HD22 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -71.7 -21.02 61.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.118 -0.492 . . . . 72.51 110.9 179.919 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 5.2 ptmt -74.77 -32.99 62.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.248 -0.433 . . . . 74.41 110.899 179.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.23 -26.4 33.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.244 -0.435 . . . . 74.05 110.852 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -65.3 -7.64 14.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.217 -0.447 . . . . 74.31 110.934 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.43 ' O ' HG23 ' A' ' 72' ' ' VAL . 8.9 m-85 . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.097 -0.501 . . . . 72.55 110.94 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.672 HD12 ' CD ' ' A' ' 16' ' ' GLN . 5.9 tt . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.743 0.306 . . . . 72.52 110.87 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -61.38 -48.78 79.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.242 -0.435 . . . . 73.13 110.893 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.79 -51.2 60.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.148 -0.478 . . . . 63.32 111.079 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.473 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.5 OUTLIER -59.78 -49.68 76.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.239 -0.437 . . . . 72.32 110.867 179.976 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.679 HD22 HD13 ' A' ' 19' ' ' LEU . 0.1 OUTLIER -55.34 -37.51 67.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.267 -0.424 . . . . 72.11 110.952 179.884 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.51 -45.58 88.47 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.219 -0.446 . . . . 62.43 110.844 179.798 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.473 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 2.2 pt-20 -60.56 -32.7 71.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.288 -0.414 . . . . 75.11 110.902 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -68.35 -34.32 75.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.032 -0.531 . . . . 63.43 110.865 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.574 ' OE1' HD11 ' A' ' 48' ' ' LEU . 4.9 mm-40 -58.35 -39.64 80.08 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.275 -0.42 . . . . 74.45 110.895 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.4 mmpt? -66.42 -28.73 68.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.22 -0.445 . . . . 71.43 110.935 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -70.49 -40.92 73.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.19 -0.459 . . . . 73.32 110.932 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.473 ' CB ' HD23 ' A' ' 48' ' ' LEU . 14.8 m-85 -82.03 -35.53 28.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.126 -0.488 . . . . 70.43 110.881 -179.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.411 ' HA3' ' HB2' ' A' ' 206' ' ' SER . . . 101.99 -8.99 56.33 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.711 -0.756 . . . . 64.34 112.518 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.574 HD11 ' OE1' ' A' ' 43' ' ' GLN . 0.7 OUTLIER -59.97 139.92 90.52 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.622 0.725 . . . . 64.11 110.922 -179.89 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.511 ' O ' HG23 ' A' ' 51' ' ' THR . 54.0 Cg_endo -69.74 -52.49 0.32 Allowed 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.651 2.234 . . . . 74.5 112.353 179.84 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.543 HD12 HG23 ' A' ' 58' ' ' VAL . 0.8 OUTLIER -52.15 108.06 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.271 -0.422 . . . . 71.22 111.167 179.868 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.511 HG23 ' O ' ' A' ' 49' ' ' PRO . 66.2 p -105.34 156.35 18.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.206 -0.452 . . . . 73.25 111.173 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 58.67 18.21 37.44 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.795 -0.716 . . . . 64.24 112.473 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -113.17 161.1 17.54 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.767 0.318 . . . . 75.23 110.887 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.447 HD23 ' CE2' ' A' ' 12' ' ' TRP . 25.8 tp -164.78 93.98 0.66 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.223 -0.444 . . . . 73.4 110.936 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 178.18 -30.91 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.157 -0.474 . . . . 44.35 110.855 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 29.7 t -89.65 -102.24 0.09 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.175 -0.466 . . . . 75.25 110.919 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 65.9 mtt-85 -84.81 -27.13 27.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.184 -0.462 . . . . 61.22 110.953 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.543 HG23 HD12 ' A' ' 50' ' ' ILE . 84.2 t -65.62 -40.77 88.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.09 -0.504 . . . . 70.12 111.125 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -76.85 -31.43 19.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.214 -0.448 . . . . 74.43 111.145 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -65.02 -44.99 87.33 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.164 -0.471 . . . . 73.45 110.836 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.573 ' CG2' HG23 ' A' ' 215' ' ' THR . 14.9 pt -59.76 -29.63 43.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.163 -0.472 . . . . 74.52 111.148 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . 0.657 ' HE3' ' HB1' ' A' ' 15' ' ' ALA . 9.7 mmm -60.64 -39.19 87.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.17 -0.468 . . . . 74.01 110.821 179.857 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -93.81 -25.64 17.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.265 -0.425 . . . . 42.22 110.905 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.69 118.35 71.53 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.605 0.717 . . . . 65.34 110.868 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.76 126.29 13.14 Favored 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.683 2.255 . . . . 72.11 112.371 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -121.29 -74.99 0.6 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.169 -0.469 . . . . 71.51 110.862 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 2.8 p -140.72 148.2 40.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.149 -0.478 . . . . 55.3 110.855 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.787 ' CA ' HG23 ' A' ' 155' ' ' THR . . . -93.9 13.88 66.48 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.701 -0.761 . . . . 64.23 112.495 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.632 HG12 ' HD2' ' A' ' 70' ' ' PRO . 0.1 OUTLIER -101.75 137.49 19.57 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.67 0.748 . . . . 74.23 111.073 -179.995 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . 0.632 ' HD2' HG12 ' A' ' 69' ' ' VAL . 53.3 Cg_endo -69.83 159.12 54.53 Favored 'Trans proline' 0 C--O 1.231 0.153 0 C-N-CA 122.677 2.251 . . . . 63.44 112.33 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -94.53 4.91 53.24 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.198 -0.456 . . . . 74.45 110.813 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.43 HG23 ' O ' ' A' ' 23' ' ' TYR . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.272 -0.422 . . . . 53.43 111.126 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo . . . . . 0 C--O 1.232 0.189 0 CA-C-O 120.804 0.252 . . . . 71.11 112.316 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.695 ' CE ' HD13 ' A' ' 237' ' ' LEU . 5.1 mttp -74.05 164.98 25.94 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.257 -0.428 . . . . 64.45 110.914 179.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . 0.499 ' CD1' ' HA ' ' A' ' 200' ' ' LEU . 19.6 m95 -52.86 132.5 37.05 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.248 -0.433 . . . . 73.31 110.87 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 5.6 t -115.08 -15.0 11.77 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.19 -0.459 . . . . 65.3 111.084 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -62.48 165.0 6.65 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.302 -0.408 . . . . 70.34 110.893 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.22 -30.26 38.59 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.165 -0.47 . . . . 71.12 110.909 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.507 HG23 ' CD2' ' A' ' 123' ' ' HIS . 1.1 p -148.12 137.84 16.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.214 -0.448 . . . . 74.14 111.174 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 97.2 t -119.1 138.66 49.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.158 -0.474 . . . . 72.25 111.141 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.684 HG22 ' HB3' ' A' ' 125' ' ' ARG . 7.5 p -115.87 168.07 10.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.157 -0.474 . . . . 71.01 111.088 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 6.5 p90 -147.08 147.08 30.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.15 -0.477 . . . . 70.51 110.979 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -146.85 136.39 22.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.136 -0.484 . . . . 71.25 110.847 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.639 ' CD1' HG11 ' A' ' 109' ' ' VAL . 16.4 mm -76.05 135.26 27.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.121 -0.49 . . . . 72.4 111.144 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.504 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 21.2 t -88.15 -40.68 13.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.191 -0.459 . . . . 60.2 111.128 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 4.3 t -153.74 158.88 41.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.178 -0.465 . . . . 64.24 110.951 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 10.5 p90 -106.1 147.71 28.64 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.248 -0.433 . . . . 72.25 110.902 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.539 ' O ' ' O ' ' A' ' 100' ' ' LEU . 0.3 OUTLIER -81.71 140.76 34.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.137 -0.483 . . . . 64.11 111.183 179.961 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -62.18 -15.98 49.95 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.244 -0.434 . . . . 72.14 110.834 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -91.16 -25.33 19.62 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.225 -0.443 . . . . 74.13 110.902 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.745 HD21 ' H ' ' A' ' 180' ' ' ASP . 18.4 mt -131.69 140.02 37.02 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.515 0.674 . . . . 72.52 110.928 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . 0.604 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.3 Cg_endo -69.8 150.87 68.53 Favored 'Trans proline' 0 C--O 1.232 0.218 0 C-N-CA 122.653 2.235 . . . . 73.11 112.309 179.872 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 3.1 t-160 -49.27 -29.99 6.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.226 -0.443 . . . . 74.11 110.823 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.604 HG22 ' HB2' ' A' ' 101' ' ' PRO . 16.6 tt -72.7 -43.16 61.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.214 -0.448 . . . . 74.02 111.136 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . 0.599 HG21 HD22 ' A' ' 100' ' ' LEU . 2.3 m -69.63 -38.13 77.06 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.132 -0.485 . . . . 52.11 111.118 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.755 HG13 ' CZ ' ' A' ' 188' ' ' PHE . 75.5 t -72.87 -44.61 57.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.226 -0.443 . . . . 71.51 111.096 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.666 ' O ' HG22 ' A' ' 109' ' ' VAL . 29.7 t70 -62.95 -43.22 99.39 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.216 -0.447 . . . . 63.44 110.87 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -70.13 -33.25 71.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.205 -0.452 . . . . 75.02 110.846 -179.839 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.586 HD23 ' HB3' ' A' ' 188' ' ' PHE . 0.0 OUTLIER -60.18 -47.59 85.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.164 -0.471 . . . . 71.04 110.9 -179.957 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.666 HG22 ' O ' ' A' ' 106' ' ' ASP . 1.4 m -55.2 -41.46 60.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.161 -0.472 . . . . 72.31 111.171 179.843 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.477 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 42.5 t -70.56 -33.64 71.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.169 -0.469 . . . . 72.14 110.858 -179.857 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.589 ' HB3' HD21 ' A' ' 189' ' ' LEU . 0.5 OUTLIER -61.59 -33.1 73.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.099 -0.5 . . . . 74.35 110.879 179.943 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.56 -40.28 9.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.193 -0.458 . . . . 74.32 111.066 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.835 HD12 HD12 ' A' ' 196' ' ' LEU . 0.3 OUTLIER -65.59 -33.62 76.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.181 -0.463 . . . . 72.0 110.913 -179.95 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 44.2 t30 -69.64 -38.23 77.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.181 -0.463 . . . . 72.34 110.899 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . 0.573 ' HB3' HD23 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -60.42 -34.23 73.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.138 -0.483 . . . . 54.12 110.865 179.897 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' TRP . . . . . 0.452 ' CZ3' HD11 ' A' ' 226' ' ' LEU . 14.5 m95 -70.23 -50.09 43.42 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.243 -0.435 . . . . 75.23 110.928 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' GLY . . . . . 0.433 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -66.34 -36.42 91.63 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.781 -0.724 . . . . 73.32 112.529 179.872 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 43.2 mtmt -61.66 -16.52 49.45 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.706 0.289 . . . . 72.42 110.838 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.704 ' HB3' HG23 ' A' ' 231' ' ' ILE . 71.3 mm-40 -101.32 13.42 35.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.276 -0.42 . . . . 75.24 110.875 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 1.021 HD12 HD12 ' A' ' 122' ' ' LEU . 5.3 pt -148.26 152.18 38.69 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.656 0.741 . . . . 71.34 111.134 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.66 4.7 1.99 Allowed 'Trans proline' 0 C--O 1.232 0.212 0 C-N-CA 122.718 2.279 . . . . 72.21 112.387 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 1.021 HD12 HD12 ' A' ' 120' ' ' ILE . 10.2 mt -60.72 -158.34 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.243 -0.435 . . . . 73.22 110.936 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.507 ' CD2' HG23 ' A' ' 88' ' ' VAL . 4.3 t60 -161.7 140.69 9.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.144 -0.48 . . . . 74.12 110.809 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . 0.411 ' CD2' HD21 ' A' ' 113' ' ' LEU . 37.9 m-85 -125.0 148.41 48.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.192 -0.458 . . . . 75.54 110.875 -179.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.684 ' HB3' HG22 ' A' ' 90' ' ' THR . 0.0 OUTLIER -124.38 141.09 52.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.154 -0.476 . . . . 75.14 110.854 -179.896 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.98 139.87 35.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.217 -0.447 . . . . 72.22 110.927 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . 0.939 HG11 ' HB2' ' A' ' 132' ' ' ALA . 17.3 m -102.81 131.97 49.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.151 -0.477 . . . . 50.13 111.15 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.451 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -144.41 -23.14 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.219 -0.446 . . . . 74.43 111.132 179.894 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' TRP . . . . . 0.451 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -138.77 109.1 6.47 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.188 -0.46 . . . . 71.25 110.896 -179.997 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 108.18 -159.84 14.12 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.714 -0.755 . . . . 62.11 112.501 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -101.89 155.66 18.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.792 0.33 . . . . 63.25 111.15 -179.877 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . 0.939 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -112.22 165.24 12.34 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.181 -0.463 . . . . 51.34 111.088 179.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -67.44 -62.8 1.24 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.181 -0.463 . . . . 75.41 110.895 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . 0.441 HG23 ' HA ' ' A' ' 169' ' ' ASP . 45.5 mt -87.67 139.8 16.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.227 -0.442 . . . . 70.51 111.163 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . 0.504 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 16.4 mmm -114.33 130.19 56.66 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.2 -0.455 . . . . 72.43 110.904 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.426 HG21 ' CG1' ' A' ' 109' ' ' VAL . 0.3 OUTLIER -111.17 88.15 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.3 -0.409 . . . . 70.04 111.119 179.969 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . 0.415 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -134.11 157.27 22.78 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.673 -0.775 . . . . 63.34 112.389 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' PHE . . . . . 0.579 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 31.2 p90 -105.43 151.62 24.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.886 0.374 . . . . 74.01 110.871 -179.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.579 ' HB2' ' O ' ' A' ' 138' ' ' PHE . . . 169.64 168.81 0.05 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.197 -0.456 . . . . 71.21 111.089 179.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 18.1 mtp180 -102.64 172.87 6.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.18 -0.463 . . . . 62.21 110.849 -179.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -54.03 -17.43 7.43 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.707 -0.759 . . . . 74.24 112.54 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -85.58 13.09 7.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.865 0.364 . . . . 75.03 111.188 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 5.1 p80 -85.91 1.91 48.12 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.21 -0.45 . . . . 71.11 110.864 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 106.07 38.47 2.31 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.764 -0.732 . . . . 45.51 112.465 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -139.71 176.47 8.71 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.844 0.354 . . . . 72.14 110.882 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 66.9 m -85.7 166.76 15.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.222 -0.445 . . . . 51.25 110.844 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 66.23 127.73 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.69 0.757 . . . . 73.4 110.89 -179.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.74 152.41 69.41 Favored 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.709 2.273 . . . . 74.53 112.408 179.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 149' ' ' PHE . . . . . 0.43 ' C ' ' H ' ' A' ' 151' ' ' GLY . 1.5 p90 -52.65 -25.58 11.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.26 -0.427 . . . . 63.52 110.887 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 75.97 -20.87 0.33 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.179 -0.464 . . . . 63.11 110.875 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . 0.43 ' H ' ' C ' ' A' ' 149' ' ' PHE . . . 81.44 -161.29 42.69 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.73 -0.748 . . . . 71.41 112.417 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.68 141.88 46.76 Favored 'Trans proline' 0 C--N 1.343 0.243 0 C-N-CA 122.683 2.255 . . . . 75.11 112.403 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 103.71 -133.29 11.4 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.746 -0.74 . . . . 70.32 112.497 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -37.34 148.31 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.943 0.401 . . . . 73.25 110.855 -179.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 155' ' ' THR . . . . . 0.787 HG23 ' CA ' ' A' ' 68' ' ' GLY . 59.6 m 65.72 115.11 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.142 -0.481 . . . . 44.41 111.108 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 156' ' ' LEU . . . . . 1.032 HD21 HG21 ' A' ' 186' ' ' ILE . 1.0 OUTLIER -103.9 -52.72 2.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.179 -0.464 . . . . 75.02 110.897 179.975 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . 0.564 ' HB1' ' O ' ' A' ' 171' ' ' HIS . . . -153.76 148.27 26.16 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.235 -0.438 . . . . 71.42 111.073 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 26.3 p-80 -111.01 117.49 33.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.21 -0.45 . . . . 72.02 110.831 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -109.81 148.3 31.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.221 -0.445 . . . . 74.42 111.071 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 -104.06 169.5 8.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.172 -0.467 . . . . 75.31 110.836 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 161' ' ' ALA . . . . . 0.612 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -104.42 161.47 22.77 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.575 0.703 . . . . 61.04 111.161 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 162' ' ' PRO . . . . . 0.612 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.9 Cg_endo -69.68 88.11 0.53 Allowed 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.724 2.283 . . . . 74.44 112.348 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -146.43 136.78 6.44 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.767 -0.73 . . . . 61.41 112.463 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 2.7 m 72.24 -69.2 0.19 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.82 0.343 . . . . 73.1 111.122 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . 160.44 -59.49 0.31 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.76 -0.733 . . . . 74.03 112.527 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 166' ' ' LEU . . . . . 0.414 ' C ' HD23 ' A' ' 166' ' ' LEU . 10.3 tt -54.07 -35.13 61.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.865 0.364 . . . . 65.12 110.944 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -74.28 -163.75 10.07 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.726 -0.75 . . . . 43.43 112.494 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 73.13 11.9 79.32 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.676 -0.773 . . . . 74.31 112.435 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 169' ' ' ASP . . . . . 0.441 ' HA ' HG23 ' A' ' 134' ' ' ILE . 61.7 m-20 -91.51 171.38 9.23 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.829 0.347 . . . . 63.41 110.855 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -117.5 131.58 56.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.211 -0.45 . . . . 74.21 111.082 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 171' ' ' HIS . . . . . 0.564 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 28.7 m170 -124.72 158.86 32.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.21 -0.45 . . . . 72.53 110.854 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 172' ' ' PHE . . . . . 0.438 ' HB3' ' CZ2' ' A' ' 178' ' ' TRP . 25.0 m-85 -134.03 143.99 48.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.183 -0.462 . . . . 71.44 110.896 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 173' ' ' ASP . . . . . 0.438 ' CB ' ' O ' ' A' ' 156' ' ' LEU . 49.1 t0 -71.07 103.28 2.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.109 -0.496 . . . . 74.11 110.829 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 174' ' ' GLU . . . . . 0.454 ' HB2' ' C ' ' A' ' 139' ' ' ALA . 0.5 OUTLIER -58.27 -16.92 15.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.158 -0.474 . . . . 72.25 110.907 -179.939 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -77.85 -15.16 59.26 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.148 -0.478 . . . . 73.32 110.851 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -89.73 176.78 6.72 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.202 -0.454 . . . . 63.2 110.878 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 77.8 mtt180 -103.02 123.05 45.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.143 -0.481 . . . . 63.14 110.882 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 178' ' ' TRP . . . . . 0.488 ' HB2' HG21 ' A' ' 97' ' ' THR . 44.4 m95 -117.48 132.38 56.56 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.217 -0.447 . . . . 72.31 110.904 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 179' ' ' THR . . . . . 0.597 HG21 ' HB3' ' A' ' 182' ' ' SER . 3.5 t -177.46 164.13 2.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.235 -0.439 . . . . 74.13 111.15 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 180' ' ' ASP . . . . . 0.745 ' H ' HD21 ' A' ' 100' ' ' LEU . 3.9 t70 -124.03 -68.77 0.85 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.211 -0.45 . . . . 45.33 110.818 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -66.15 -10.87 53.8 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.772 -0.728 . . . . 62.41 112.548 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 182' ' ' SER . . . . . 0.597 ' HB3' HG21 ' A' ' 179' ' ' THR . 0.2 OUTLIER -97.65 -24.34 15.56 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.887 0.375 . . . . 64.5 110.854 -179.766 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 183' ' ' SER . . . . . 0.435 ' C ' ' O ' ' A' ' 182' ' ' SER . 1.8 p 34.55 65.43 0.34 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.133 -0.485 . . . . 64.12 110.815 -179.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -117.1 -33.76 4.6 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.157 -0.474 . . . . 74.2 110.895 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -124.54 -136.33 4.6 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.797 -0.716 . . . . 73.01 112.508 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 186' ' ' ILE . . . . . 1.032 HG21 HD21 ' A' ' 156' ' ' LEU . 7.3 mm -79.21 105.88 9.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-O 120.872 0.368 . . . . 73.22 111.092 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -51.07 123.9 10.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.138 -0.483 . . . . 71.31 110.838 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 188' ' ' PHE . . . . . 0.755 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 4.3 t80 -53.6 -35.52 60.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.171 -0.468 . . . . 75.45 110.896 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . 0.589 HD21 ' HB3' ' A' ' 111' ' ' LYS . 0.1 OUTLIER -67.46 -47.38 70.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.113 -0.494 . . . . 52.02 110.915 -179.892 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -66.06 -37.55 86.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.159 -0.473 . . . . 74.22 110.948 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -72.54 -35.34 68.02 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.109 -0.496 . . . . 50.03 111.095 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 192' ' ' ALA . . . . . 0.705 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -60.8 -44.62 96.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.235 -0.439 . . . . 52.11 111.04 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -58.1 -44.47 87.69 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.219 -0.446 . . . . 72.43 111.162 -179.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 2.8 t60 -72.58 -42.76 64.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.138 -0.483 . . . . 71.44 110.842 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -68.84 -47.23 66.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.233 -0.44 . . . . 71.01 111.114 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 196' ' ' LEU . . . . . 0.835 HD12 HD12 ' A' ' 113' ' ' LEU . 4.5 mm? -63.13 -43.61 97.91 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.239 -0.437 . . . . 74.51 110.912 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -56.2 -29.29 56.02 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.707 -0.758 . . . . 52.23 112.522 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 198' ' ' HIS . . . . . 0.481 ' CD2' HG21 ' A' ' 69' ' ' VAL . 5.9 m-70 -68.03 -40.32 82.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.864 0.364 . . . . 75.21 110.899 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.85 -21.17 62.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.17 -0.468 . . . . 71.13 110.828 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 200' ' ' LEU . . . . . 0.499 ' HA ' ' CD1' ' A' ' 84' ' ' TRP . 0.6 OUTLIER -90.44 2.75 55.35 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.147 -0.479 . . . . 64.13 110.915 179.992 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 83.71 -4.03 83.5 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.729 -0.748 . . . . 50.41 112.483 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 202' ' ' MET . . . . . 0.496 ' SD ' HD12 ' A' ' 234' ' ' ILE . 97.9 mmm -63.85 133.46 53.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.789 0.328 . . . . 63.21 110.877 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -101.48 -176.34 28.6 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.781 -0.724 . . . . 64.44 112.526 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 20.7 m-70 -73.84 144.34 45.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.798 0.332 . . . . 74.32 110.893 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -103.93 153.46 20.77 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.249 -0.432 . . . . 53.34 110.838 -179.776 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 206' ' ' SER . . . . . 0.411 ' HB2' ' HA3' ' A' ' 47' ' ' GLY . 6.5 p -87.79 -4.78 58.86 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.486 . . . . 72.22 110.814 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.55 137.82 83.4 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.619 0.723 . . . . 65.11 110.881 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 -6.62 19.01 Favored 'Trans proline' 0 C--N 1.342 0.222 0 C-N-CA 122.682 2.254 . . . . 74.53 112.336 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -127.92 30.16 5.31 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.189 -0.46 . . . . 63.52 110.886 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 210' ' ' ALA . . . . . 0.48 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.22 145.51 26.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.194 -0.457 . . . . 62.23 111.132 179.851 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 211' ' ' VAL . . . . . 0.409 HG12 ' OD2' ' A' ' 230' ' ' ASP . 0.4 OUTLIER -68.35 -27.52 37.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.238 -0.437 . . . . 62.04 111.145 179.954 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -98.25 10.53 40.41 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.209 -0.451 . . . . 75.22 110.846 179.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 213' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -55.71 118.08 18.19 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.698 0.761 . . . . 73.43 110.909 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.82 -18.47 36.71 Favored 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 122.611 2.207 . . . . 63.01 112.363 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 215' ' ' THR . . . . . 0.573 HG23 ' CG2' ' A' ' 61' ' ' ILE . 0.3 OUTLIER -84.79 49.97 1.82 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.174 -0.466 . . . . 74.24 111.172 179.988 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 5.5 t80 . . . . . 0 C--N 1.328 -0.346 0 CA-C-N 116.202 -0.454 . . . . 74.14 110.925 -179.915 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.458 -0.029 0 CA-C-O 120.906 0.384 . . . . 65.01 110.938 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -143.87 -167.9 2.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.087 -0.506 . . . . 64.24 110.919 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 226' ' ' LEU . . . . . 0.684 ' HB3' HD11 ' A' ' 231' ' ' ILE . 0.6 OUTLIER -59.56 149.2 30.73 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.262 -0.426 . . . . 53.44 110.939 179.885 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 227' ' ' SER . . . . . 0.48 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 1.4 t -86.93 154.84 20.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 74.21 110.932 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -62.82 -65.35 0.7 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.214 -0.448 . . . . 74.54 110.897 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -55.59 -26.09 41.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.225 -0.443 . . . . 72.22 110.863 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 230' ' ' ASP . . . . . 0.409 ' OD2' HG12 ' A' ' 211' ' ' VAL . 21.4 m-20 -69.64 -48.25 60.58 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.198 -0.456 . . . . 74.23 110.872 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 231' ' ' ILE . . . . . 0.704 HG23 ' HB3' ' A' ' 119' ' ' GLU . 8.6 mt -68.29 -42.82 84.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.171 -0.468 . . . . 73.41 111.211 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.21 -32.58 74.02 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.104 -0.498 . . . . 65.42 110.888 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -65.8 -48.3 68.01 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.748 -0.739 . . . . 63.43 112.495 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 234' ' ' ILE . . . . . 0.496 HD12 ' SD ' ' A' ' 202' ' ' MET . 11.8 tt -72.82 -30.61 33.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.79 0.328 . . . . 71.54 111.113 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -70.24 -24.03 63.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.147 -0.479 . . . . 70.33 110.907 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 236' ' ' LYS . . . . . 0.418 ' HE2' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.49 -27.29 60.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.199 -0.455 . . . . 51.21 110.908 179.974 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 237' ' ' LEU . . . . . 0.695 HD13 ' CE ' ' A' ' 83' ' ' LYS . 9.8 tt -98.03 -32.55 11.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.167 -0.47 . . . . 75.41 110.911 179.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 238' ' ' TYR . . . . . 0.438 ' CE2' HD11 ' A' ' 122' ' ' LEU . 32.4 m-85 -91.87 -35.18 14.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.2 -0.455 . . . . 51.24 110.917 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.33 0 C-N-CA 120.746 -0.74 . . . . 32.22 112.494 179.979 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 5.4 t-105 . . . . . 0 C--O 1.23 0.066 0 CA-C-O 120.699 0.285 . . . . 71.22 110.933 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -73.31 -39.16 65.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.259 -0.428 . . . . 72.51 110.921 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 -74.05 -35.97 64.35 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.135 -0.484 . . . . 61.24 110.93 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.575 ' CB ' HD11 ' A' ' 59' ' ' ILE . . . -56.91 -44.16 82.13 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.225 -0.443 . . . . 54.34 111.123 179.894 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -73.53 -37.41 65.62 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.189 -0.46 . . . . 73.12 110.889 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -67.92 -30.98 70.44 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.174 -0.466 . . . . 72.4 110.93 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -69.95 -35.99 74.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.207 -0.451 . . . . 75.11 110.944 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.485 HD11 ' SD ' ' A' ' 42' ' ' MET . 0.4 OUTLIER -68.78 -20.93 64.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.17 -0.468 . . . . 72.51 110.923 179.985 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.405 ' HG2' ' N ' ' A' ' 21' ' ' ARG . 5.7 ptmt -74.85 -31.48 61.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.168 -0.469 . . . . 74.41 110.903 179.788 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.405 ' N ' ' HG2' ' A' ' 20' ' ' LYS . 2.2 ptp180 -86.37 -27.93 23.94 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.202 -0.454 . . . . 74.05 110.896 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.0 m-30 -77.82 -0.84 28.78 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.256 -0.429 . . . . 74.31 110.856 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.406 ' O ' ' HB2' ' A' ' 70' ' ' PRO . 2.9 m-85 . . . . . 0 C--N 1.329 -0.326 0 CA-C-N 116.112 -0.495 . . . . 72.55 110.946 -179.808 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.618 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 3.6 mm? . . . . . 0 CA--C 1.526 0.041 0 CA-C-O 120.743 0.306 . . . . 72.52 110.901 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.472 ' HA ' HD12 ' A' ' 39' ' ' LEU . 0.9 OUTLIER -56.75 -50.37 72.46 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.165 -0.47 . . . . 73.13 110.88 179.916 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -52.64 -36.56 56.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.161 -0.472 . . . . 63.32 111.111 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.465 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.1 OUTLIER -70.7 -41.61 71.73 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.182 -0.463 . . . . 72.32 110.92 179.931 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.618 ' HG ' ' O ' ' A' ' 35' ' ' LEU . 25.4 mt -54.32 -38.05 65.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.215 -0.448 . . . . 72.11 110.951 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.0 mttt -58.72 -45.57 89.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.16 -0.473 . . . . 62.43 110.929 179.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.465 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 2.3 pt-20 -60.93 -32.68 72.17 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.219 -0.446 . . . . 75.11 110.912 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.707 ' HE1' HG13 ' A' ' 58' ' ' VAL . 4.5 ttt -66.83 -34.16 77.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.15 -0.477 . . . . 63.43 110.926 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.756 ' OE1' HD11 ' A' ' 48' ' ' LEU . 2.5 mm-40 -58.67 -40.05 82.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.455 . . . . 74.45 110.89 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.7 mmpt? -72.79 -33.49 66.3 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.233 -0.44 . . . . 71.43 110.875 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 32.7 t80 -71.0 -37.18 72.67 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.26 -0.427 . . . . 73.32 110.848 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.526 ' CB ' HD23 ' A' ' 48' ' ' LEU . 6.8 m-85 -81.78 -35.22 29.8 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.22 -0.446 . . . . 70.43 110.931 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 105.83 -10.34 44.76 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.748 -0.739 . . . . 64.34 112.509 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.756 HD11 ' OE1' ' A' ' 43' ' ' GLN . 0.9 OUTLIER -66.0 135.79 95.35 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.619 0.723 . . . . 64.11 110.898 -179.906 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.76 -52.9 0.3 Allowed 'Trans proline' 0 C--N 1.342 0.228 0 C-N-CA 122.697 2.264 . . . . 74.5 112.325 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.455 ' O ' HD12 ' A' ' 48' ' ' LEU . 0.9 OUTLIER -52.67 108.22 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.205 -0.452 . . . . 71.22 111.13 179.949 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.687 HG22 ' CB ' ' A' ' 43' ' ' GLN . 21.1 p -107.88 168.09 9.52 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.165 -0.47 . . . . 73.25 111.126 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 60.16 16.92 43.49 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.688 -0.768 . . . . 64.24 112.494 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . 0.568 ' O ' HG21 ' A' ' 58' ' ' VAL . 1.0 OUTLIER -128.12 134.02 49.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.772 0.32 . . . . 75.23 110.844 -179.907 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.43 ' HA ' ' HB ' ' A' ' 58' ' ' VAL . 24.6 tp -145.36 93.1 2.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.193 -0.458 . . . . 73.4 110.892 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.6 p30 174.38 -29.68 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.219 -0.446 . . . . 44.35 110.925 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 24.1 t -83.86 -97.68 0.06 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.151 -0.477 . . . . 75.25 110.833 -179.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 8.8 tpt180 -85.09 -33.05 22.5 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.14 -0.482 . . . . 61.22 110.949 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.707 HG13 ' HE1' ' A' ' 42' ' ' MET . 44.7 t -59.06 -49.34 83.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.191 -0.459 . . . . 70.12 111.148 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.575 HD11 ' CB ' ' A' ' 15' ' ' ALA . 0.5 OUTLIER -63.99 -30.9 51.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.162 -0.472 . . . . 74.43 111.082 179.913 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.01 -40.4 84.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.261 -0.427 . . . . 73.45 110.931 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.689 HD13 HG22 ' A' ' 215' ' ' THR . 0.8 OUTLIER -78.26 -30.1 15.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.133 -0.485 . . . . 74.52 111.144 179.937 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 7.9 mmm -68.18 -35.14 77.55 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.181 -0.463 . . . . 74.01 110.893 179.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -83.87 -24.33 30.91 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.182 -0.463 . . . . 42.22 110.918 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.25 148.48 50.11 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.54 0.686 . . . . 65.34 110.958 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.8 154.22 67.85 Favored 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.663 2.242 . . . . 72.11 112.344 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 40.9 ttp180 -153.38 -84.02 0.07 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.225 -0.443 . . . . 71.51 110.872 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -145.48 156.19 43.57 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.178 -0.465 . . . . 55.3 110.925 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.527 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -100.12 20.55 48.39 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.701 -0.762 . . . . 64.23 112.488 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.763 HG12 ' HD2' ' A' ' 70' ' ' PRO . 0.0 OUTLIER -111.29 141.88 25.28 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.725 0.774 . . . . 74.23 111.122 179.979 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . 0.763 ' HD2' HG12 ' A' ' 69' ' ' VAL . 54.4 Cg_endo -69.71 139.02 39.36 Favored 'Trans proline' 0 C--N 1.342 0.207 0 C-N-CA 122.736 2.291 . . . . 63.44 112.349 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 87.7 m-20 -61.55 -17.01 53.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.191 -0.459 . . . . 74.45 110.89 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.186 -0.461 . . . . 53.43 111.165 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.821 0.259 . . . . 71.11 112.29 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.697 ' HD2' HD22 ' A' ' 237' ' ' LEU . 1.9 mttp -82.33 163.35 21.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.24 -0.436 . . . . 64.45 110.905 179.874 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . 0.502 ' CD1' ' HA ' ' A' ' 200' ' ' LEU . 47.0 m95 -62.95 135.2 57.17 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.226 -0.443 . . . . 73.31 110.955 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.35 1.37 13.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.303 -0.408 . . . . 65.3 111.154 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -77.81 163.71 25.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.152 -0.476 . . . . 70.34 110.908 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.72 -6.81 59.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.156 -0.475 . . . . 71.12 110.929 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.438 HG23 ' CD2' ' A' ' 123' ' ' HIS . 0.3 OUTLIER -170.51 138.83 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.206 -0.452 . . . . 74.14 111.141 179.9 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 95.9 t -123.39 135.62 62.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.234 -0.439 . . . . 72.25 111.088 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.693 HG22 ' HB3' ' A' ' 125' ' ' ARG . 9.5 p -115.07 168.1 10.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.155 -0.475 . . . . 71.01 111.142 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.404 ' N ' ' CD1' ' A' ' 91' ' ' TYR . 2.9 p90 -144.58 147.42 33.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.18 -0.464 . . . . 70.51 110.947 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.408 ' CB ' ' HB3' ' A' ' 132' ' ' ALA . 5.4 tpt85 -148.03 134.72 19.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.138 -0.483 . . . . 71.25 110.871 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.437 HD11 ' HA ' ' A' ' 106' ' ' ASP . 10.2 mm -77.21 135.32 26.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.183 -0.462 . . . . 72.4 111.128 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.473 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 18.3 t -93.98 -40.5 11.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.22 -0.445 . . . . 60.2 111.138 179.857 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -151.63 169.56 21.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.081 -0.509 . . . . 64.24 110.848 -179.865 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 16.1 p90 -130.12 155.24 46.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.141 -0.481 . . . . 72.25 110.971 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.5 t -100.64 142.19 32.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 64.11 111.136 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -52.08 -18.46 1.44 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.215 -0.448 . . . . 72.14 110.859 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.97 -36.7 85.23 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.186 -0.461 . . . . 74.13 110.863 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.435 HD23 HG21 ' A' ' 104' ' ' THR . 1.7 mp -144.07 152.81 55.72 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-O 121.623 0.725 . . . . 72.52 110.934 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . 0.57 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.7 Cg_endo -69.83 151.27 68.6 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.662 2.241 . . . . 73.11 112.319 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 2.7 t-160 -50.8 -28.3 9.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.18 -0.464 . . . . 74.11 110.88 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.57 HG22 ' HB2' ' A' ' 101' ' ' PRO . 2.7 tp -75.65 -38.32 37.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.205 -0.452 . . . . 74.02 111.068 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . 0.771 ' O ' HD22 ' A' ' 108' ' ' LEU . 3.1 m -69.21 -37.88 78.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.168 -0.469 . . . . 52.11 111.125 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.805 ' O ' HG13 ' A' ' 109' ' ' VAL . 65.5 t -71.68 -44.48 69.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.214 -0.448 . . . . 71.51 111.15 179.885 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.648 ' O ' HG22 ' A' ' 109' ' ' VAL . 26.9 t0 -63.96 -38.55 91.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 63.44 110.85 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . 0.498 ' HG3' ' N ' ' A' ' 108' ' ' LEU . 0.0 OUTLIER -70.55 -33.44 71.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.189 -0.46 . . . . 75.02 110.875 -179.89 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.771 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -66.21 -48.55 70.25 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.201 -0.454 . . . . 71.04 110.922 -179.993 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.805 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.5 m -55.01 -43.17 68.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.189 -0.459 . . . . 72.31 111.06 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.487 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 45.3 t -70.65 -33.93 71.49 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.194 -0.457 . . . . 72.14 110.869 -179.789 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.48 ' HB3' HD21 ' A' ' 189' ' ' LEU . 0.3 OUTLIER -62.1 -33.17 73.94 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.087 -0.506 . . . . 74.35 110.928 179.927 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.71 -40.27 9.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.244 -0.434 . . . . 74.32 111.135 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.788 HD12 HD12 ' A' ' 196' ' ' LEU . 0.4 OUTLIER -64.32 -33.04 74.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.135 -0.484 . . . . 72.0 110.915 179.981 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 45.0 t30 -69.82 -40.14 76.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.174 -0.466 . . . . 72.34 110.876 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . 0.441 ' HB3' HD23 ' A' ' 226' ' ' LEU . 0.4 OUTLIER -59.71 -34.33 72.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.163 -0.471 . . . . 54.12 110.921 179.905 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' TRP . . . . . 0.554 ' CZ3' HD11 ' A' ' 226' ' ' LEU . 13.3 m95 -65.8 -52.24 52.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.223 -0.444 . . . . 75.23 110.922 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' GLY . . . . . 0.447 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -63.52 -34.01 88.8 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.694 -0.765 . . . . 73.32 112.497 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.4 mtmt -63.67 -14.44 52.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.752 0.31 . . . . 72.42 110.892 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.425 ' HB3' HG23 ' A' ' 231' ' ' ILE . 61.2 mm-40 -104.04 13.27 32.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.233 -0.44 . . . . 75.24 110.894 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 1.01 HD12 HD12 ' A' ' 122' ' ' LEU . 6.7 pt -147.71 153.13 42.58 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.653 0.74 . . . . 71.34 111.149 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 1.99 3.91 Favored 'Trans proline' 0 C--N 1.342 0.226 0 C-N-CA 122.658 2.239 . . . . 72.21 112.362 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 1.01 HD12 HD12 ' A' ' 120' ' ' ILE . 5.9 mt -61.46 -158.25 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.208 -0.451 . . . . 73.22 110.885 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.438 ' CD2' HG23 ' A' ' 88' ' ' VAL . 5.0 t60 -160.15 145.05 14.82 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.116 -0.493 . . . . 74.12 110.843 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . 0.5 ' CD2' HD21 ' A' ' 113' ' ' LEU . 42.4 m-85 -126.08 148.94 49.23 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.174 -0.466 . . . . 75.54 110.882 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.693 ' HB3' HG22 ' A' ' 90' ' ' THR . 0.0 OUTLIER -128.01 140.96 51.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.16 -0.473 . . . . 75.14 110.857 -179.921 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . 0.401 ' HD3' ' N ' ' A' ' 127' ' ' VAL . 0.0 OUTLIER -81.01 141.19 34.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 72.22 110.869 179.988 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . 0.952 HG11 ' HB2' ' A' ' 132' ' ' ALA . 22.2 m -102.92 133.79 45.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.214 -0.448 . . . . 50.13 111.177 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.427 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -147.06 -24.83 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.191 -0.459 . . . . 74.43 111.19 179.886 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' TRP . . . . . 0.427 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -136.72 109.15 7.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.117 -0.492 . . . . 71.25 110.885 179.972 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.44 -159.74 14.39 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.756 -0.735 . . . . 62.11 112.482 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -101.8 155.54 18.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.786 0.326 . . . . 63.25 111.168 -179.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . 0.952 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -112.07 165.38 12.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.2 -0.455 . . . . 51.34 111.083 179.86 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -66.48 -62.8 1.27 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.191 -0.459 . . . . 75.41 110.853 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . 0.494 HG23 ' HA ' ' A' ' 169' ' ' ASP . 37.6 mt -86.41 130.48 36.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.211 -0.45 . . . . 70.51 111.143 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . 0.473 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 13.7 mmm -107.06 124.9 50.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.12 -0.491 . . . . 72.43 110.914 179.877 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -108.52 92.29 2.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.23 -0.441 . . . . 70.04 111.096 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . 0.429 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -130.31 170.15 20.99 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.738 -0.744 . . . . 63.34 112.497 179.865 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' PHE . . . . . 0.462 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 48.2 m-85 -108.61 149.62 28.65 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.875 0.369 . . . . 74.01 110.938 -179.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.606 ' HB1' ' CB ' ' A' ' 143' ' ' HIS . . . 175.83 166.91 0.39 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.456 . . . . 71.21 111.1 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 22.2 mtm180 -104.26 173.09 6.45 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.214 -0.448 . . . . 62.21 110.908 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -58.09 -15.73 23.04 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.722 -0.751 . . . . 74.24 112.466 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -99.05 13.36 33.09 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.769 0.319 . . . . 75.03 111.165 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 143' ' ' HIS . . . . . 0.606 ' CB ' ' HB1' ' A' ' 139' ' ' ALA . 5.0 p80 -72.26 -8.86 57.13 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.172 -0.467 . . . . 71.11 110.843 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 117.95 50.38 0.35 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.773 -0.727 . . . . 45.51 112.55 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -172.7 171.86 4.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.808 0.337 . . . . 72.14 110.911 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 27.1 p -64.09 -179.79 0.46 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.18 -0.464 . . . . 51.25 110.849 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 147' ' ' TYR . . . . . 0.44 ' HA ' ' HD2' ' A' ' 148' ' ' PRO . 0.3 OUTLIER 64.48 103.92 0.03 OUTLIER Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.727 0.775 . . . . 73.4 110.949 -179.905 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 148' ' ' PRO . . . . . 0.44 ' HD2' ' HA ' ' A' ' 147' ' ' TYR . 54.2 Cg_endo -69.77 151.97 69.17 Favored 'Trans proline' 0 C--N 1.342 0.228 0 C-N-CA 122.612 2.208 . . . . 74.53 112.372 179.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 149' ' ' PHE . . . . . 0.404 ' O ' ' CG ' ' A' ' 150' ' ' ASP . 0.3 OUTLIER -53.38 -24.26 11.83 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.166 -0.47 . . . . 63.52 110.842 -179.942 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . 0.404 ' CG ' ' O ' ' A' ' 149' ' ' PHE . 1.9 p30 44.93 25.43 0.15 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.191 -0.459 . . . . 63.11 110.861 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 44.69 -165.05 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.719 -0.753 . . . . 71.41 112.48 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.72 144.36 53.98 Favored 'Trans proline' 0 C--N 1.343 0.24 0 C-N-CA 122.632 2.222 . . . . 75.11 112.36 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . 0.457 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 105.57 -131.76 10.8 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.775 -0.726 . . . . 70.32 112.445 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 154' ' ' ASN . . . . . 0.457 ' C ' ' O ' ' A' ' 153' ' ' GLY . 3.5 p30 -33.37 135.82 0.11 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.851 0.358 . . . . 73.25 110.891 -179.875 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 155' ' ' THR . . . . . 0.524 HG23 ' HA2' ' A' ' 68' ' ' GLY . 0.2 OUTLIER 74.24 101.88 0.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.234 -0.439 . . . . 44.41 111.189 -179.965 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 156' ' ' LEU . . . . . 1.045 HD21 HG21 ' A' ' 186' ' ' ILE . 0.4 OUTLIER -82.41 -56.89 3.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.16 -0.473 . . . . 75.02 110.94 179.98 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . 0.527 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -162.87 149.09 12.39 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.245 -0.434 . . . . 71.42 111.131 179.769 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 18.9 p-80 -105.19 126.09 51.71 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.267 -0.424 . . . . 72.02 110.809 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -110.53 153.06 25.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.181 -0.463 . . . . 74.42 111.105 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 15.1 m-85 -108.55 152.25 25.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.23 -0.441 . . . . 75.31 110.877 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 161' ' ' ALA . . . . . 0.712 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -96.66 164.16 18.75 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.617 0.722 . . . . 61.04 111.112 179.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 162' ' ' PRO . . . . . 0.712 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.5 Cg_endo -69.76 85.33 0.62 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.672 2.248 . . . . 74.44 112.361 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -134.57 127.63 4.55 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.718 -0.753 . . . . 61.41 112.462 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 2.7 m 72.72 -69.78 0.18 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.847 0.356 . . . . 73.1 111.102 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . 166.61 -59.44 0.23 Allowed Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.767 -0.73 . . . . 74.03 112.454 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 166' ' ' LEU . . . . . 0.484 ' C ' HD23 ' A' ' 166' ' ' LEU . 8.7 tt -53.99 -37.7 64.29 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.741 0.305 . . . . 65.12 110.891 -179.915 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -73.98 -166.19 13.21 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.68 -0.772 . . . . 43.43 112.519 179.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 73.01 18.04 78.93 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.642 -0.789 . . . . 74.31 112.483 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 169' ' ' ASP . . . . . 0.494 ' HA ' HG23 ' A' ' 134' ' ' ILE . 74.9 m-20 -91.97 -172.4 3.15 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.796 0.331 . . . . 63.41 110.824 -179.876 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -124.47 131.36 53.49 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.19 -0.459 . . . . 74.21 111.116 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 171' ' ' HIS . . . . . 0.502 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 10.9 m170 -129.0 137.91 51.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.216 -0.447 . . . . 72.53 110.809 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 47.1 m-85 -121.55 140.33 52.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.208 -0.451 . . . . 71.44 110.899 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 55.6 t0 -73.47 100.84 3.35 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.203 -0.453 . . . . 74.11 110.902 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.83 -16.42 11.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.115 -0.493 . . . . 72.25 110.86 -179.886 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -79.03 -16.37 56.94 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.125 -0.489 . . . . 73.32 110.875 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 31.4 mm-40 -83.48 -175.79 5.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.194 -0.457 . . . . 63.2 110.824 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -112.18 116.53 30.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.136 -0.484 . . . . 63.14 110.857 -179.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 49.6 m95 -116.82 139.41 50.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.176 -0.466 . . . . 72.31 110.947 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 179' ' ' THR . . . . . 0.515 HG21 ' HB3' ' A' ' 182' ' ' SER . 9.0 t -177.46 163.6 1.99 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.221 -0.445 . . . . 74.13 111.231 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -125.12 -68.86 0.82 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.241 -0.436 . . . . 45.33 110.852 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -64.81 -12.15 52.59 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.706 -0.759 . . . . 62.41 112.523 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 182' ' ' SER . . . . . 0.515 ' HB3' HG21 ' A' ' 179' ' ' THR . 0.4 OUTLIER -94.52 -24.44 17.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.925 0.393 . . . . 64.5 110.876 -179.743 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 183' ' ' SER . . . . . 0.425 ' C ' ' O ' ' A' ' 182' ' ' SER . 3.2 p 35.32 58.03 0.82 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.103 -0.499 . . . . 64.12 110.894 -179.821 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -116.85 -33.53 4.75 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.101 -0.5 . . . . 74.2 110.915 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -119.79 -139.37 5.9 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.696 -0.764 . . . . 73.01 112.414 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 186' ' ' ILE . . . . . 1.045 HG21 HD21 ' A' ' 156' ' ' LEU . 6.9 mm -79.47 100.08 3.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.864 0.364 . . . . 73.22 111.118 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 28.6 m-20 -49.19 121.7 5.18 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.195 -0.457 . . . . 71.31 110.944 179.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 188' ' ' PHE . . . . . 0.773 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.5 t80 -54.03 -36.25 62.83 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.196 -0.456 . . . . 75.45 110.884 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . 0.59 HD12 ' HE2' ' A' ' 224' ' ' PHE . 0.2 OUTLIER -67.57 -47.62 69.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.139 -0.482 . . . . 52.02 110.867 -179.934 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 44.3 t80 -69.48 -38.94 77.92 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.256 -0.429 . . . . 74.22 110.901 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 191' ' ' ALA . . . . . 0.671 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -72.13 -35.23 69.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.154 -0.475 . . . . 50.03 111.133 179.894 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 192' ' ' ALA . . . . . 0.641 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -57.12 -45.02 83.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.161 -0.472 . . . . 52.11 111.031 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.97 -42.71 90.58 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.231 -0.44 . . . . 72.43 111.181 -179.886 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 194' ' ' HIS . . . . . 0.425 ' HE2' ' CE1' ' A' ' 204' ' ' HIS . 15.0 t-160 -73.21 -38.56 66.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.228 -0.442 . . . . 71.44 110.909 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -75.38 -48.51 22.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 71.01 111.052 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 196' ' ' LEU . . . . . 0.788 HD12 HD12 ' A' ' 113' ' ' LEU . 4.5 mm? -63.81 -40.02 95.63 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.236 -0.438 . . . . 74.51 110.943 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -58.91 -28.59 63.65 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.742 -0.742 . . . . 52.23 112.436 179.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 198' ' ' HIS . . . . . 0.473 ' CD2' HG21 ' A' ' 69' ' ' VAL . 7.1 m-70 -69.29 -32.42 71.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.738 0.304 . . . . 75.21 110.793 -179.892 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -70.94 -21.26 62.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.207 -0.451 . . . . 71.13 110.874 -179.748 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 200' ' ' LEU . . . . . 0.502 ' HA ' ' CD1' ' A' ' 84' ' ' TRP . 0.3 OUTLIER -92.54 4.82 52.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.099 -0.501 . . . . 64.13 110.938 -179.984 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 83.37 -9.52 61.23 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.735 -0.745 . . . . 50.41 112.473 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 202' ' ' MET . . . . . 0.434 ' HE2' ' HB3' ' A' ' 202' ' ' MET . 0.0 OUTLIER -54.83 135.0 48.23 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.88 0.372 . . . . 63.21 110.854 -179.99 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -109.79 159.22 14.08 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.768 -0.73 . . . . 64.44 112.409 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 204' ' ' HIS . . . . . 0.425 ' CE1' ' HE2' ' A' ' 194' ' ' HIS . 12.4 m-70 -52.47 155.78 2.02 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.88 0.371 . . . . 74.32 110.837 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 205' ' ' SER . . . . . 0.427 ' HB2' ' HB1' ' A' ' 210' ' ' ALA . 0.5 OUTLIER -117.27 153.01 33.67 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.182 -0.463 . . . . 53.34 110.855 -179.784 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 5.2 p -87.73 -4.9 58.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.157 -0.474 . . . . 72.22 110.859 -179.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -71.65 140.53 84.26 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.657 0.741 . . . . 65.11 110.886 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.82 -6.32 18.34 Favored 'Trans proline' 0 C--N 1.342 0.21 0 C-N-CA 122.693 2.262 . . . . 74.53 112.332 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 2.9 p30 -126.85 32.25 5.15 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.23 -0.441 . . . . 63.52 110.874 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 210' ' ' ALA . . . . . 0.492 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.11 146.07 26.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 62.23 111.103 179.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -73.63 -27.09 22.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 62.04 111.148 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 212' ' ' MET . . . . . 0.419 ' HE1' ' O ' ' A' ' 202' ' ' MET . 3.2 mmm -97.54 14.1 27.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.194 -0.457 . . . . 75.22 110.876 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 213' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -55.23 121.98 40.23 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-O 121.612 0.72 . . . . 73.43 110.992 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.73 -18.79 36.94 Favored 'Trans proline' 0 N--CA 1.465 -0.203 0 C-N-CA 122.716 2.278 . . . . 63.01 112.364 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 215' ' ' THR . . . . . 0.689 HG22 HD13 ' A' ' 61' ' ' ILE . 5.9 p -84.37 53.28 2.59 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.247 -0.433 . . . . 74.24 111.14 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 8.0 t80 . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.224 -0.444 . . . . 74.14 110.955 -179.978 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 224' ' ' PHE . . . . . 0.59 ' HE2' HD12 ' A' ' 189' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.909 0.385 . . . . 65.01 110.848 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -143.99 -178.19 5.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.185 -0.461 . . . . 64.24 110.875 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 226' ' ' LEU . . . . . 0.867 ' HB3' HD11 ' A' ' 231' ' ' ILE . 0.7 OUTLIER -59.71 148.02 35.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 53.44 110.909 179.925 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 227' ' ' SER . . . . . 0.492 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 1.4 t -90.71 151.62 21.16 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.198 -0.455 . . . . 74.21 110.826 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 42.6 tt0 -67.46 -60.7 2.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.088 -0.505 . . . . 74.54 110.958 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -58.36 -26.08 62.75 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.214 -0.448 . . . . 72.22 110.865 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -69.78 -48.82 57.82 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.19 -0.459 . . . . 74.23 110.904 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 231' ' ' ILE . . . . . 0.867 HD11 ' HB3' ' A' ' 226' ' ' LEU . 10.5 mt -68.63 -44.83 82.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 73.41 111.153 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.2 -32.77 66.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.176 -0.466 . . . . 65.42 110.902 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -64.26 -49.79 63.99 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.703 -0.76 . . . . 63.43 112.456 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 234' ' ' ILE . . . . . 0.492 HD13 HG21 ' A' ' 120' ' ' ILE . 12.8 tt -73.15 -31.82 36.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.72 0.295 . . . . 71.54 111.115 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -62.65 -24.3 67.54 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.142 -0.481 . . . . 70.33 110.895 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 236' ' ' LYS . . . . . 0.449 ' HE3' ' HB2' ' A' ' 237' ' ' LEU . 0.1 OUTLIER -74.66 -22.11 59.06 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.2 -0.455 . . . . 51.21 110.868 179.994 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 237' ' ' LEU . . . . . 0.697 HD22 ' HD2' ' A' ' 83' ' ' LYS . 10.6 tt -97.34 -33.73 11.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.206 -0.452 . . . . 75.41 110.926 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 238' ' ' TYR . . . . . . . . . . . . . 47.4 m-85 -92.04 -35.31 14.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.174 -0.466 . . . . 51.24 110.902 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.355 0 C-N-CA 120.709 -0.757 . . . . 32.22 112.508 179.983 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.515 ' CE2' HD23 ' A' ' 54' ' ' LEU . 16.0 t-105 . . . . . 0 C--O 1.23 0.073 0 CA-C-O 120.73 0.3 . . . . 71.22 110.86 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 78.4 tt0 -62.31 -35.25 78.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.222 -0.445 . . . . 72.51 110.814 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 64.0 mm-40 -74.24 -36.61 63.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.171 -0.468 . . . . 61.24 110.914 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.89 -43.78 78.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.202 -0.453 . . . . 54.34 111.125 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.761 ' HB3' HD21 ' A' ' 35' ' ' LEU . 0.0 OUTLIER -73.07 -32.18 64.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.182 -0.463 . . . . 73.12 110.933 -179.938 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 83.4 m-20 -77.66 -30.91 52.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.174 -0.466 . . . . 72.4 110.898 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.97 -35.69 75.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.153 -0.476 . . . . 75.11 110.938 -179.848 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.661 HD13 ' O ' ' A' ' 19' ' ' LEU . 3.0 tm? -71.26 -21.41 62.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.118 -0.492 . . . . 72.51 110.92 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 4.1 ptmt -75.32 -28.6 59.72 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.188 -0.46 . . . . 74.41 110.919 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.8 ptp180 -86.36 -27.11 24.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.213 -0.448 . . . . 74.05 110.912 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -59.67 -25.32 64.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.181 -0.463 . . . . 74.31 110.877 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.566 ' HB3' HG21 ' A' ' 72' ' ' VAL . 14.5 m-85 . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.125 -0.489 . . . . 72.55 110.924 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.761 HD21 ' HB3' ' A' ' 16' ' ' GLN . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.756 0.312 . . . . 72.52 110.916 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.4 -51.38 63.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.222 -0.444 . . . . 73.13 110.849 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.28 -51.17 68.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.159 -0.473 . . . . 63.32 111.06 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 5.1 mmtt -59.74 -49.48 77.56 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.209 -0.45 . . . . 72.32 110.917 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.461 ' CD2' HD23 ' A' ' 35' ' ' LEU . 0.1 OUTLIER -55.19 -38.74 68.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 72.11 110.964 179.892 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.38 -46.49 88.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 62.43 111.005 179.751 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -70.39 -37.06 74.45 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.173 -0.467 . . . . 75.11 110.925 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 3.2 ttt -68.73 -46.0 70.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.197 -0.456 . . . . 63.43 110.893 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.626 ' HG2' HD11 ' A' ' 48' ' ' LEU . 18.5 mt-30 -57.31 -43.5 83.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.235 -0.439 . . . . 74.45 110.921 179.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.6 mmpt? -69.14 -26.73 65.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.213 -0.449 . . . . 71.43 110.86 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -69.99 -36.25 75.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.26 -0.427 . . . . 73.32 110.926 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.561 ' HB3' HD23 ' A' ' 48' ' ' LEU . 6.1 m-85 -80.48 -30.65 37.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.115 -0.493 . . . . 70.43 110.85 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 105.55 -10.55 46.04 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.749 -0.739 . . . . 64.34 112.465 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.626 HD11 ' HG2' ' A' ' 43' ' ' GLN . 0.6 OUTLIER -63.13 140.06 97.62 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.576 0.703 . . . . 64.11 110.938 -179.881 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.75 -51.9 0.36 Allowed 'Trans proline' 0 C--O 1.231 0.169 0 C-N-CA 122.669 2.246 . . . . 74.5 112.325 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.587 HD13 ' HB2' ' A' ' 56' ' ' SER . 0.7 OUTLIER -48.82 108.21 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.238 -0.437 . . . . 71.22 111.146 179.936 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 1.8 t -111.28 159.33 18.04 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.167 -0.47 . . . . 73.25 111.054 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 58.37 17.07 30.71 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.799 -0.715 . . . . 64.24 112.49 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.2 mtp -127.49 161.05 29.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.823 0.344 . . . . 75.23 110.828 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.515 HD23 ' CE2' ' A' ' 12' ' ' TRP . 20.4 tp -154.38 96.81 1.96 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.223 -0.444 . . . . 73.4 110.944 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 177.51 -32.13 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.2 -0.454 . . . . 44.35 110.933 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . 0.587 ' HB2' HD13 ' A' ' 50' ' ' ILE . 5.0 m -79.51 -100.71 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.162 -0.472 . . . . 75.25 110.795 -179.834 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.0 mmt85 -84.82 -29.4 25.39 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.166 -0.47 . . . . 61.22 110.864 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.517 HG23 HD12 ' A' ' 50' ' ' ILE . 16.3 t -58.84 -44.06 89.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.234 -0.439 . . . . 70.12 111.124 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.416 HD13 ' HA ' ' A' ' 59' ' ' ILE . 3.4 mm -75.51 -31.31 23.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.19 -0.459 . . . . 74.43 111.116 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.94 -44.55 92.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.148 -0.478 . . . . 73.45 110.874 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.428 HD12 ' CZ ' ' A' ' 46' ' ' PHE . 30.3 pt -64.9 -29.89 48.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.196 -0.456 . . . . 74.52 111.117 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 8.1 mmt -65.16 -36.88 85.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.227 -0.442 . . . . 74.01 110.909 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -90.59 -24.59 20.51 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.177 -0.465 . . . . 42.22 110.948 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 2.8 tppt? -84.88 130.76 51.35 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.552 0.692 . . . . 65.34 110.961 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 126.08 12.89 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.657 2.238 . . . . 72.11 112.36 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.42 ' O ' HD23 ' A' ' 156' ' ' LEU . 19.7 ttp180 -122.18 -84.67 0.66 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.191 -0.459 . . . . 71.51 110.883 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -145.96 147.46 31.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.18 -0.464 . . . . 55.3 110.891 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.59 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -98.41 20.85 48.8 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.74 -0.743 . . . . 64.23 112.518 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.516 HG21 ' CD2' ' A' ' 198' ' ' HIS . 0.1 OUTLIER -109.62 130.83 22.35 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.609 0.719 . . . . 74.23 111.165 179.999 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . 0.466 ' HB3' ' O ' ' A' ' 23' ' ' TYR . 54.3 Cg_endo -69.79 159.39 53.56 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.647 2.231 . . . . 63.44 112.367 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -113.52 28.62 8.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.237 -0.438 . . . . 74.45 110.872 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.566 HG21 ' HB3' ' A' ' 23' ' ' TYR . 3.2 m . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.165 -0.471 . . . . 53.43 111.163 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo . . . . . 0 C--O 1.231 0.144 0 CA-C-O 120.878 0.282 . . . . 71.11 112.313 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.724 ' HD2' HD13 ' A' ' 237' ' ' LEU . 2.7 mtpt -96.77 164.72 12.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.167 -0.47 . . . . 64.45 110.932 179.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . 0.699 ' CE3' HG21 ' A' ' 89' ' ' VAL . 40.8 m0 -46.42 110.5 0.28 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.227 -0.442 . . . . 73.31 110.914 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 15.2 t -115.1 1.26 13.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.248 -0.433 . . . . 65.3 111.169 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.4 172.68 3.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.221 -0.445 . . . . 70.34 110.849 -179.837 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.408 ' O ' ' HB3' ' A' ' 123' ' ' HIS . 0.0 OUTLIER -80.4 -30.43 37.77 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.162 -0.472 . . . . 71.12 110.899 179.88 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.411 HG23 ' CD2' ' A' ' 123' ' ' HIS . 0.3 OUTLIER -159.66 144.83 6.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.449 . . . . 74.14 111.163 179.92 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.699 HG21 ' CE3' ' A' ' 84' ' ' TRP . 12.9 t -127.68 131.92 69.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.252 -0.431 . . . . 72.25 111.15 179.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.525 ' C ' ' HB1' ' A' ' 132' ' ' ALA . 22.9 p -115.44 150.51 36.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.222 -0.444 . . . . 71.01 111.165 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 5.7 p90 -130.85 146.41 52.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.191 -0.459 . . . . 70.51 110.931 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 12.6 ttt180 -149.14 137.0 20.54 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.091 -0.504 . . . . 71.25 110.887 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.48 HD11 ' HA ' ' A' ' 106' ' ' ASP . 11.7 mm -75.02 135.25 27.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.153 -0.476 . . . . 72.4 111.157 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.433 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 18.4 t -90.19 -40.51 12.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.189 -0.46 . . . . 60.2 111.105 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 36.2 t -153.94 169.48 23.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.225 -0.443 . . . . 64.24 110.88 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 14.7 p90 -133.07 155.11 49.82 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.111 -0.495 . . . . 72.25 110.954 -179.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.9 t -99.43 141.91 31.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.165 -0.471 . . . . 64.11 111.16 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 7.7 ptp85 -52.01 -19.98 2.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.215 -0.448 . . . . 72.14 110.826 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . 0.408 ' OD2' HD12 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -70.9 -34.77 71.88 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.261 -0.427 . . . . 74.13 110.808 -179.964 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.645 HD22 HG21 ' A' ' 104' ' ' THR . 6.5 mt -136.08 141.14 35.28 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.628 0.728 . . . . 72.52 110.888 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . 0.589 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.8 Cg_endo -69.78 151.0 68.84 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.717 2.278 . . . . 73.11 112.316 179.879 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 2.3 t-160 -53.52 -25.38 16.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.222 -0.445 . . . . 74.11 110.864 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.589 HG22 ' HB2' ' A' ' 101' ' ' PRO . 15.1 tt -77.43 -41.16 29.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.217 -0.447 . . . . 74.02 111.12 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . 0.793 ' O ' HD22 ' A' ' 108' ' ' LEU . 6.6 m -69.32 -39.05 78.44 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.224 -0.444 . . . . 52.11 111.206 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.8 ' O ' HG13 ' A' ' 109' ' ' VAL . 71.7 t -71.21 -45.5 70.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.157 -0.474 . . . . 71.51 111.112 179.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.614 ' O ' HG22 ' A' ' 109' ' ' VAL . 53.6 t0 -63.32 -39.86 95.74 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.196 -0.457 . . . . 63.44 110.854 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . 0.497 ' HG3' ' N ' ' A' ' 108' ' ' LEU . 0.1 OUTLIER -70.15 -33.57 71.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.232 -0.44 . . . . 75.02 110.891 -179.865 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.793 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -65.17 -48.47 73.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.133 -0.485 . . . . 71.04 110.887 -179.957 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.8 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.2 m -55.15 -42.49 65.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.226 -0.443 . . . . 72.31 111.144 179.842 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.484 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 30.9 t -70.15 -34.71 73.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.13 -0.487 . . . . 72.14 110.869 -179.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.462 ' CG ' HD21 ' A' ' 189' ' ' LEU . 0.3 OUTLIER -62.74 -33.43 75.11 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.124 -0.489 . . . . 74.35 110.895 179.93 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -93.51 -42.08 9.43 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.228 -0.442 . . . . 74.32 111.113 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.732 ' CD1' HD12 ' A' ' 196' ' ' LEU . 0.4 OUTLIER -66.1 -34.14 77.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.243 -0.435 . . . . 72.0 110.958 179.984 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . 0.4 ' CB ' ' O ' ' A' ' 110' ' ' SER . 22.2 t30 -68.6 -35.42 77.32 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.148 -0.478 . . . . 72.34 110.862 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . 0.417 ' O ' ' HG2' ' A' ' 119' ' ' GLU . 0.0 OUTLIER -65.19 -34.14 77.67 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.236 -0.438 . . . . 54.12 110.882 179.923 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 14.6 m95 -67.01 -45.37 77.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.193 -0.458 . . . . 75.23 110.876 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' GLY . . . . . 0.413 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -67.96 -36.5 86.41 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.73 -0.747 . . . . 73.32 112.49 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.26 -17.41 53.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.767 0.317 . . . . 72.42 110.948 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.773 ' HB3' HG23 ' A' ' 231' ' ' ILE . 9.7 mm-40 -99.99 13.46 33.89 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.247 -0.433 . . . . 75.24 110.898 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 1.013 HD12 HD12 ' A' ' 122' ' ' LEU . 7.7 pt -149.28 143.69 17.18 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.521 0.677 . . . . 71.34 111.166 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 26.0 0.18 Allowed 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.625 2.216 . . . . 72.21 112.355 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 1.013 HD12 HD12 ' A' ' 120' ' ' ILE . 12.5 mt -78.99 -161.19 0.28 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 73.22 110.903 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.411 ' CD2' HG23 ' A' ' 88' ' ' VAL . 3.3 t60 -150.63 121.06 7.37 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.148 -0.478 . . . . 74.12 110.865 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 9.2 m-30 -110.61 147.47 34.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.22 -0.445 . . . . 75.54 110.925 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.424 ' O ' HG22 ' A' ' 90' ' ' THR . 0.0 OUTLIER -131.14 142.07 50.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.455 . . . . 75.14 110.923 -179.946 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.37 160.09 25.51 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.234 -0.439 . . . . 72.22 110.929 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . 0.733 HG11 ' HB2' ' A' ' 132' ' ' ALA . 17.8 m -103.29 126.57 57.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.258 -0.428 . . . . 50.13 111.062 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.595 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -146.9 -11.19 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.138 -0.483 . . . . 74.43 111.066 179.966 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' TRP . . . . . 0.595 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -156.78 109.05 2.49 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.203 -0.453 . . . . 71.25 110.95 179.993 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 103.04 -164.93 15.89 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.79 -0.719 . . . . 62.11 112.541 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.97 155.44 18.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.798 0.332 . . . . 63.25 111.122 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . 0.733 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -112.46 165.55 12.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.242 -0.436 . . . . 51.34 111.093 179.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -76.03 -40.99 52.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.206 -0.452 . . . . 75.41 110.857 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . 0.492 HG23 ' O ' ' A' ' 168' ' ' GLY . 3.1 mm -93.93 107.65 19.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.168 -0.469 . . . . 70.51 111.164 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . 0.433 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 8.1 mmm -99.58 121.55 41.36 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.207 -0.451 . . . . 72.43 110.897 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -106.96 97.15 5.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.252 -0.431 . . . . 70.04 111.125 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -129.85 168.1 21.38 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.728 -0.749 . . . . 63.34 112.466 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' PHE . . . . . 0.591 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 44.4 m-85 -105.25 143.46 33.39 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.808 0.337 . . . . 74.01 110.911 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.591 ' HB2' ' O ' ' A' ' 138' ' ' PHE . . . 168.28 166.27 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.132 -0.486 . . . . 71.21 111.044 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.415 ' HB2' ' HB3' ' A' ' 149' ' ' PHE . 1.5 ptp180 -107.5 174.33 5.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.22 -0.445 . . . . 62.21 110.846 -179.894 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . 0.562 ' H ' ' HA ' ' A' ' 149' ' ' PHE . . . -54.4 -17.55 8.49 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.785 -0.721 . . . . 74.24 112.463 -179.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 142' ' ' ALA . . . . . 0.558 ' HB2' ' HD2' ' A' ' 149' ' ' PHE . . . -89.17 13.26 13.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.899 0.381 . . . . 75.03 111.115 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 143' ' ' HIS . . . . . 0.433 ' HB3' ' HB1' ' A' ' 139' ' ' ALA . 6.4 p80 -79.71 0.19 31.53 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.217 -0.447 . . . . 71.11 110.858 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 105.49 51.6 0.85 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.725 -0.75 . . . . 45.51 112.447 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -165.76 175.56 8.67 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.788 0.328 . . . . 72.14 110.898 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.93 177.11 0.82 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 51.25 110.9 -179.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 64.69 119.31 0.02 OUTLIER Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.71 0.767 . . . . 73.4 110.936 -179.861 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.72 151.3 69.27 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 122.676 2.251 . . . . 74.53 112.38 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 149' ' ' PHE . . . . . 0.562 ' HA ' ' H ' ' A' ' 141' ' ' GLY . 2.0 p90 -53.72 -32.89 53.73 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.246 -0.434 . . . . 63.52 110.894 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . 0.519 ' CG ' ' O ' ' A' ' 149' ' ' PHE . 2.8 p30 49.99 15.87 0.2 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.123 -0.49 . . . . 63.11 110.815 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . 0.421 ' C ' ' O ' ' A' ' 150' ' ' ASP . . . 36.72 -153.16 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.723 -0.751 . . . . 71.41 112.457 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 143.58 51.42 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.624 2.216 . . . . 75.11 112.354 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . 0.445 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 105.11 -132.53 11.14 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.753 -0.737 . . . . 70.32 112.559 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 154' ' ' ASN . . . . . 0.445 ' C ' ' O ' ' A' ' 153' ' ' GLY . 2.1 p30 -34.67 143.39 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.96 0.409 . . . . 73.25 110.8 -179.889 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 155' ' ' THR . . . . . 0.504 HG22 ' CA ' ' A' ' 68' ' ' GLY . 0.2 OUTLIER 67.69 109.58 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.114 -0.494 . . . . 44.41 111.148 -179.991 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 156' ' ' LEU . . . . . 1.028 HD21 HG21 ' A' ' 186' ' ' ILE . 0.8 OUTLIER -88.56 -55.41 3.73 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.253 -0.43 . . . . 75.02 110.928 179.962 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . 0.59 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -159.87 148.75 17.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.152 -0.476 . . . . 71.42 111.038 179.81 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 27.3 p-80 -108.25 125.68 51.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.136 -0.484 . . . . 72.02 110.89 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -110.34 166.53 10.91 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.215 -0.448 . . . . 74.42 111.106 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 21.2 m-30 -115.7 147.32 41.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.257 -0.429 . . . . 75.31 110.887 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 161' ' ' ALA . . . . . 0.706 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -79.99 164.28 53.62 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.608 0.718 . . . . 61.04 111.056 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 162' ' ' PRO . . . . . 0.706 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.3 Cg_endo -69.81 71.44 1.54 Allowed 'Trans proline' 0 N--CA 1.465 -0.154 0 C-N-CA 122.742 2.295 . . . . 74.44 112.306 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -127.44 100.31 0.54 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.763 -0.732 . . . . 61.41 112.518 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 66.9 172.35 0.25 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.85 0.357 . . . . 73.1 111.095 -179.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -54.35 -37.13 59.13 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.753 -0.737 . . . . 74.03 112.466 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 166' ' ' LEU . . . . . 0.657 HD23 ' O ' ' A' ' 166' ' ' LEU . 4.0 tt -71.26 -19.64 62.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.792 0.33 . . . . 65.12 110.945 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -93.57 144.64 17.21 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.757 -0.735 . . . . 43.43 112.496 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 168' ' ' GLY . . . . . 0.492 ' O ' HG23 ' A' ' 134' ' ' ILE . . . 102.75 13.04 30.85 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.778 -0.725 . . . . 74.31 112.5 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 29.4 m-20 -82.62 167.62 18.11 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.856 0.36 . . . . 63.41 110.86 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -125.75 130.68 51.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.208 -0.451 . . . . 74.21 111.114 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 171' ' ' HIS . . . . . 0.576 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 23.1 m170 -130.66 132.05 45.21 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.286 -0.415 . . . . 72.53 110.887 179.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -115.8 139.41 50.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 71.44 110.859 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 48.3 t0 -71.31 99.77 2.01 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.121 -0.49 . . . . 74.11 110.854 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 1.6 pp20? -57.21 -16.99 9.42 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.231 -0.441 . . . . 72.25 110.913 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -76.36 -16.21 59.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.17 -0.468 . . . . 73.32 110.887 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 23.6 mm-40 -84.34 -174.62 5.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.2 -0.455 . . . . 63.2 110.903 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 12.2 mtt85 -116.49 116.26 27.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.189 -0.46 . . . . 63.14 110.828 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 178' ' ' TRP . . . . . 0.405 ' CE3' ' HB ' ' A' ' 186' ' ' ILE . 13.0 m95 -116.95 146.29 43.08 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.135 -0.484 . . . . 72.31 110.854 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 179' ' ' THR . . . . . 0.576 HG21 ' HB3' ' A' ' 182' ' ' SER . 7.4 t -178.93 163.8 1.41 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.25 -0.432 . . . . 74.13 111.14 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -123.49 -68.11 0.89 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.45 . . . . 45.33 110.901 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -66.63 -10.83 55.68 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.829 -0.701 . . . . 62.41 112.475 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 182' ' ' SER . . . . . 0.576 ' HB3' HG21 ' A' ' 179' ' ' THR . 0.3 OUTLIER -97.32 -24.43 15.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.911 0.386 . . . . 64.5 110.842 -179.716 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 183' ' ' SER . . . . . 0.455 ' C ' ' O ' ' A' ' 182' ' ' SER . 2.9 p 33.33 60.99 0.45 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.107 -0.497 . . . . 64.12 110.926 -179.754 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 16.5 tp -116.85 -33.57 4.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.114 -0.494 . . . . 74.2 110.921 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -121.58 -137.4 5.22 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.747 -0.739 . . . . 73.01 112.514 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 186' ' ' ILE . . . . . 1.028 HG21 HD21 ' A' ' 156' ' ' LEU . 6.6 mm -79.47 99.92 3.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.827 0.346 . . . . 73.22 111.165 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 27.1 m120 -50.93 121.98 6.8 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.2 -0.454 . . . . 71.31 110.85 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 188' ' ' PHE . . . . . 0.782 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.6 t80 -53.93 -35.7 61.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.136 -0.484 . . . . 75.45 110.886 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . 0.462 HD21 ' CG ' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -67.21 -47.6 70.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.181 -0.463 . . . . 52.02 110.881 -179.958 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 6.2 t80 -69.52 -37.26 77.07 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.165 -0.47 . . . . 74.22 110.944 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 191' ' ' ALA . . . . . 0.563 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -72.65 -35.78 67.84 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.098 -0.501 . . . . 50.03 111.071 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 192' ' ' ALA . . . . . 0.739 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -61.48 -44.59 96.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.247 -0.433 . . . . 52.11 111.107 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 193' ' ' THR . . . . . 0.51 HG21 HG21 ' A' ' 211' ' ' VAL . 17.7 m -58.52 -45.22 89.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.172 -0.467 . . . . 72.43 111.136 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 20.8 t-160 -72.59 -40.11 66.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.181 -0.463 . . . . 71.44 110.838 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -71.02 -47.0 61.16 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.232 -0.44 . . . . 71.01 111.165 179.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 196' ' ' LEU . . . . . 0.739 HD23 ' O ' ' A' ' 192' ' ' ALA . 4.5 mm? -64.88 -38.88 92.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.225 -0.443 . . . . 74.51 110.898 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -62.48 -26.69 68.46 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.673 -0.775 . . . . 52.23 112.483 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 198' ' ' HIS . . . . . 0.516 ' CD2' HG21 ' A' ' 69' ' ' VAL . 4.6 m-70 -65.24 -41.47 94.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.864 0.364 . . . . 75.21 110.93 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . 0.479 ' HG ' ' HZ2' ' A' ' 84' ' ' TRP . 31.9 t -64.57 -22.4 66.96 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.134 -0.485 . . . . 71.13 110.893 -179.782 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 2.4 mt -83.11 -2.55 55.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.059 -0.519 . . . . 64.13 110.865 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 84.09 4.7 88.19 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.715 -0.755 . . . . 50.41 112.501 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 202' ' ' MET . . . . . 0.423 ' CE ' ' HB ' ' A' ' 234' ' ' ILE . 43.8 tpp -65.82 144.61 56.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.836 0.35 . . . . 63.21 110.874 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -106.19 159.09 15.24 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.761 -0.733 . . . . 64.44 112.546 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 27.2 m-70 -58.1 166.12 1.68 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.796 0.332 . . . . 74.32 110.913 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 2.1 t -128.56 149.18 50.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.24 -0.436 . . . . 53.34 110.825 -179.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 1.1 m -88.07 -4.28 58.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.081 -0.509 . . . . 72.22 110.843 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 207' ' ' ASP . . . . . 0.429 ' O ' ' CD1' ' A' ' 213' ' ' TYR . 0.1 OUTLIER -71.27 135.51 84.51 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.59 0.709 . . . . 65.11 110.845 -179.962 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.7 -7.7 21.72 Favored 'Trans proline' 0 C--O 1.231 0.148 0 C-N-CA 122.691 2.26 . . . . 74.53 112.352 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 -127.53 24.27 6.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.258 -0.428 . . . . 63.52 110.89 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 210' ' ' ALA . . . . . 0.445 ' O ' ' HB2' ' A' ' 213' ' ' TYR . . . -87.55 145.76 26.08 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.112 -0.495 . . . . 62.23 111.113 179.831 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 211' ' ' VAL . . . . . 0.51 HG21 HG21 ' A' ' 193' ' ' THR . 0.4 OUTLIER -68.44 -24.94 30.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.144 -0.48 . . . . 62.04 111.146 -179.985 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 1.5 mpp? -95.09 9.7 38.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.464 . . . . 75.22 110.885 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 213' ' ' TYR . . . . . 0.445 ' HB2' ' O ' ' A' ' 210' ' ' ALA . 1.8 t80 -55.06 116.75 12.15 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.689 0.757 . . . . 73.43 110.961 -179.884 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.81 -17.98 37.02 Favored 'Trans proline' 0 C--O 1.232 0.208 0 C-N-CA 122.639 2.226 . . . . 63.01 112.353 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -83.93 2.85 36.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.251 -0.431 . . . . 74.24 111.132 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 1.2 t80 . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 116.239 -0.437 . . . . 74.14 110.901 -179.967 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.105 0 CA-C-O 120.929 0.395 . . . . 65.01 110.899 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.87 169.32 18.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.096 -0.502 . . . . 64.24 110.914 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 226' ' ' LEU . . . . . 0.754 HD13 ' HG3' ' A' ' 119' ' ' GLU . 0.9 OUTLIER -59.83 150.73 27.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.205 -0.452 . . . . 53.44 110.898 179.935 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 227' ' ' SER . . . . . 0.445 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 9.8 t -85.4 159.12 20.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.173 -0.467 . . . . 74.21 110.866 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -64.24 -67.24 0.45 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.163 -0.472 . . . . 74.54 110.926 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -55.12 -25.68 33.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.164 -0.471 . . . . 72.22 110.935 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 230' ' ' ASP . . . . . 0.62 ' OD2' HD23 ' A' ' 226' ' ' LEU . 9.9 t0 -69.09 -48.47 62.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.184 -0.462 . . . . 74.23 110.814 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 231' ' ' ILE . . . . . 0.773 HG23 ' HB3' ' A' ' 119' ' ' GLU . 10.2 mt -68.22 -42.94 85.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.216 -0.447 . . . . 73.41 111.137 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 35.4 pttt -65.14 -32.25 73.85 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.164 -0.471 . . . . 65.42 110.872 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -62.8 -48.89 77.51 Favored Glycine 0 C--N 1.33 0.225 0 C-N-CA 120.704 -0.76 . . . . 63.43 112.449 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 234' ' ' ILE . . . . . 0.423 ' HB ' ' CE ' ' A' ' 202' ' ' MET . 11.4 tt -73.05 -31.95 37.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.782 0.325 . . . . 71.54 111.095 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -67.69 -32.71 73.55 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.225 -0.443 . . . . 70.33 110.873 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 236' ' ' LYS . . . . . 0.45 ' HE3' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.17 -22.01 59.6 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.187 -0.46 . . . . 51.21 110.907 179.964 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 237' ' ' LEU . . . . . 0.724 HD13 ' HD2' ' A' ' 83' ' ' LYS . 5.7 tt -97.62 -28.2 14.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.264 -0.425 . . . . 75.41 110.957 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 238' ' ' TYR . . . . . 0.488 ' CE2' HD11 ' A' ' 122' ' ' LEU . 4.4 m-85 -92.12 -35.67 13.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.145 -0.48 . . . . 51.24 110.964 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.327 0 C-N-CA 120.72 -0.752 . . . . 32.22 112.508 179.952 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 13.0 t-105 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.697 0.284 . . . . 71.22 110.908 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -60.24 -35.27 75.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.301 -0.409 . . . . 72.51 110.869 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.94 -36.63 84.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.151 -0.477 . . . . 61.24 110.905 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.13 -35.85 69.97 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.257 -0.429 . . . . 54.34 111.112 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.612 ' NE2' HD22 ' A' ' 35' ' ' LEU . 0.6 OUTLIER -72.49 -42.95 64.32 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.222 -0.444 . . . . 73.12 110.91 -179.926 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.68 -32.64 74.08 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.201 -0.454 . . . . 72.4 110.938 179.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -70.02 -41.87 73.74 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 75.11 110.933 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.705 HD21 ' HG3' ' A' ' 42' ' ' MET . 6.5 mt -71.64 -32.82 68.37 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.131 -0.486 . . . . 72.51 110.841 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.45 ' HE2' ' HA ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -57.04 -37.53 71.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.217 -0.447 . . . . 74.41 110.885 179.918 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.45 ' HA ' ' HE2' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -85.01 -26.62 26.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.201 -0.454 . . . . 74.05 110.869 179.968 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.423 ' HB2' ' HA ' ' A' ' 19' ' ' LEU . 1.5 m-85 -59.53 -38.6 81.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.147 -0.478 . . . . 74.31 110.852 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.57 ' HE2' HD22 ' A' ' 19' ' ' LEU . 2.4 p90 . . . . . 0 C--N 1.328 -0.346 0 CA-C-N 116.189 -0.46 . . . . 72.55 110.936 -179.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.612 HD22 ' NE2' ' A' ' 16' ' ' GLN . 32.5 tp . . . . . 0 C--O 1.23 0.062 0 CA-C-O 120.794 0.331 . . . . 72.52 110.927 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -57.14 -51.11 70.61 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.127 -0.488 . . . . 73.13 110.858 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.65 -36.33 83.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.172 -0.467 . . . . 63.32 111.153 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.404 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.2 OUTLIER -66.51 -49.07 67.75 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.16 -0.473 . . . . 72.32 110.945 179.945 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.801 HD13 HD23 ' A' ' 54' ' ' LEU . 11.3 mt -54.62 -38.2 66.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.268 -0.424 . . . . 72.11 110.925 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.7 mmmt -59.44 -45.87 90.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.159 -0.473 . . . . 62.43 110.877 179.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.404 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 3.3 pt-20 -69.91 -33.78 72.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.203 -0.453 . . . . 75.11 110.9 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.746 ' HE1' HD11 ' A' ' 61' ' ' ILE . 0.3 OUTLIER -68.47 -46.86 68.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.111 -0.495 . . . . 63.43 110.902 179.959 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.559 ' HB3' HG22 ' A' ' 51' ' ' THR . 1.7 mt-30 -57.66 -40.34 79.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.27 -0.423 . . . . 74.45 110.941 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.0 mmpt? -69.82 -25.7 63.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.255 -0.429 . . . . 71.43 110.877 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -70.08 -36.07 74.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.241 -0.436 . . . . 73.32 110.89 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.628 ' CZ ' HD12 ' A' ' 61' ' ' ILE . 28.2 m-85 -80.49 -27.17 37.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.146 -0.479 . . . . 70.43 110.882 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.434 ' HA2' ' HB2' ' A' ' 206' ' ' SER . . . 102.53 -10.3 56.15 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.716 -0.754 . . . . 64.34 112.479 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.549 HD11 ' CG ' ' A' ' 43' ' ' GLN . 0.8 OUTLIER -65.56 140.52 97.57 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.566 0.698 . . . . 64.11 110.899 -179.927 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.665 ' O ' HG23 ' A' ' 51' ' ' THR . 54.7 Cg_endo -69.73 -54.4 0.22 Allowed 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.662 2.241 . . . . 74.5 112.435 179.79 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.558 HD12 ' CG2' ' A' ' 58' ' ' VAL . 0.8 OUTLIER -50.4 108.25 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.189 -0.46 . . . . 71.22 111.166 179.865 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.665 HG23 ' O ' ' A' ' 49' ' ' PRO . 73.6 p -121.96 159.04 27.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.189 -0.46 . . . . 73.25 111.178 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 82.92 -10.69 56.87 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.79 -0.719 . . . . 64.24 112.439 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . 0.421 ' O ' HG21 ' A' ' 58' ' ' VAL . 30.5 mtp -135.22 161.12 36.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.808 0.337 . . . . 75.23 110.842 -179.909 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.801 HD23 HD13 ' A' ' 39' ' ' LEU . 1.4 pp -160.15 129.42 5.09 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.192 -0.458 . . . . 73.4 110.967 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 p30 172.0 -29.04 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.193 -0.458 . . . . 44.35 110.924 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 2.7 m -97.54 -85.38 0.36 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.188 -0.46 . . . . 75.25 110.806 -179.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.595 ' O ' HG23 ' A' ' 61' ' ' ILE . 18.6 tpt180 -84.46 -39.34 19.05 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.12 -0.491 . . . . 61.22 110.859 -179.927 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.558 ' CG2' HD12 ' A' ' 50' ' ' ILE . 15.8 t -59.01 -43.94 90.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.261 -0.427 . . . . 70.12 111.064 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -74.38 -31.17 27.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.23 -0.441 . . . . 74.43 111.133 179.898 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.77 -33.06 71.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.465 . . . . 73.45 110.872 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.746 HD11 ' HE1' ' A' ' 42' ' ' MET . 0.6 OUTLIER -69.94 -29.68 41.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.137 -0.483 . . . . 74.52 111.128 -179.956 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 10.8 mtt -68.04 -35.17 77.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.178 -0.465 . . . . 74.01 110.888 179.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -86.9 -24.05 24.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.234 -0.439 . . . . 42.22 110.912 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.31 123.26 73.35 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.639 0.733 . . . . 65.34 110.801 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.77 147.2 62.27 Favored 'Trans proline' 0 N--CA 1.465 -0.181 0 C-N-CA 122.693 2.262 . . . . 72.11 112.373 179.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.507 ' O ' HD23 ' A' ' 156' ' ' LEU . 0.2 OUTLIER -150.4 -76.34 0.15 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.245 -0.434 . . . . 71.51 110.88 -179.895 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -144.94 153.94 42.06 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.166 -0.47 . . . . 55.3 110.874 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.53 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -103.97 24.07 30.47 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.736 -0.745 . . . . 64.23 112.501 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.622 HG21 ' CD2' ' A' ' 198' ' ' HIS . 0.2 OUTLIER -104.96 136.71 19.13 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 121.65 0.738 . . . . 74.23 111.063 -179.963 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . 0.584 ' HD2' HG12 ' A' ' 69' ' ' VAL . 53.8 Cg_endo -69.71 162.21 42.92 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.683 2.255 . . . . 63.44 112.333 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -128.59 43.03 3.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.206 -0.452 . . . . 74.45 110.842 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.178 -0.464 . . . . 53.43 111.115 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo . . . . . 0 C--O 1.231 0.172 0 CA-C-O 120.864 0.277 . . . . 71.11 112.306 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.683 ' CD ' HD13 ' A' ' 237' ' ' LEU . 2.3 mttp -77.72 171.4 15.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.239 -0.437 . . . . 64.45 110.922 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . 0.425 ' CD1' ' HA ' ' A' ' 200' ' ' LEU . 75.9 m95 -66.38 134.84 53.39 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.23 -0.441 . . . . 73.31 110.9 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 5.5 t -115.26 1.36 13.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.259 -0.428 . . . . 65.3 111.172 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -74.95 -178.85 3.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.252 -0.431 . . . . 70.34 110.842 -179.881 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 15.2 mttt -103.08 -8.78 20.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.136 -0.484 . . . . 71.12 110.861 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.632 HG23 ' HD2' ' A' ' 123' ' ' HIS . 0.3 OUTLIER -153.54 144.92 14.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.258 -0.428 . . . . 74.14 111.097 179.966 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 97.4 t -123.62 130.34 74.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.171 -0.468 . . . . 72.25 111.118 179.91 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -116.2 156.34 26.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.164 -0.471 . . . . 71.01 111.097 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 4.8 p90 -147.09 146.84 30.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.254 -0.43 . . . . 70.51 110.967 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -151.15 135.56 16.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.1 -0.5 . . . . 71.25 110.832 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.434 HD11 ' HA ' ' A' ' 106' ' ' ASP . 13.7 mm -75.27 131.67 34.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.185 -0.461 . . . . 72.4 111.144 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.407 ' HB ' ' HA3' ' A' ' 137' ' ' GLY . 16.4 t -88.34 -40.21 13.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.462 . . . . 60.2 111.1 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 3.4 t -151.46 169.63 21.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.186 -0.461 . . . . 64.24 110.803 -179.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 11.5 p90 -130.16 154.16 47.8 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.124 -0.489 . . . . 72.25 110.909 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 3.4 t -102.3 141.64 34.8 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.099 -0.5 . . . . 64.11 111.109 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 4.8 mmp_? -52.63 -17.95 1.54 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.187 -0.46 . . . . 72.14 110.937 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.88 -36.87 85.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.156 -0.475 . . . . 74.13 110.862 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.418 HD11 ' HA ' ' A' ' 179' ' ' THR . 1.7 mp -143.13 152.11 57.27 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-O 121.617 0.722 . . . . 72.52 110.932 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . 0.574 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.9 Cg_endo -69.71 151.03 69.27 Favored 'Trans proline' 0 C--O 1.233 0.226 0 C-N-CA 122.694 2.262 . . . . 73.11 112.38 179.866 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 3.3 t-160 -52.96 -26.59 15.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.251 -0.431 . . . . 74.11 110.91 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.574 HG22 ' HB2' ' A' ' 101' ' ' PRO . 0.0 OUTLIER -76.46 -39.23 33.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.178 -0.464 . . . . 74.02 111.078 -179.999 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . 0.632 ' O ' HD22 ' A' ' 108' ' ' LEU . 3.0 m -69.47 -39.67 77.56 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.146 -0.479 . . . . 52.11 111.11 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.781 ' O ' HG13 ' A' ' 109' ' ' VAL . 72.4 t -72.74 -46.37 53.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.302 -0.408 . . . . 71.51 111.114 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.658 ' O ' HG22 ' A' ' 109' ' ' VAL . 59.7 t0 -58.45 -45.53 88.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.17 -0.468 . . . . 63.44 110.845 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 12.2 ptm180 -70.39 -34.08 72.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.222 -0.445 . . . . 75.02 110.797 -179.785 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.632 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -60.87 -48.68 80.69 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.234 -0.439 . . . . 71.04 110.97 -179.999 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.781 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.5 m -55.33 -41.47 61.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.152 -0.476 . . . . 72.31 111.11 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.462 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 47.0 t -70.11 -33.35 71.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.15 -0.477 . . . . 72.14 110.81 -179.775 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.431 ' HB3' HD21 ' A' ' 189' ' ' LEU . 0.4 OUTLIER -61.56 -32.92 73.02 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.165 -0.47 . . . . 74.35 110.864 179.952 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.81 -40.15 9.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.246 -0.434 . . . . 74.32 111.134 179.773 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.82 ' CD1' HD12 ' A' ' 196' ' ' LEU . 0.6 OUTLIER -65.1 -33.4 75.94 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.218 -0.446 . . . . 72.0 110.884 -179.945 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -70.45 -42.63 71.26 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.208 -0.451 . . . . 72.34 110.884 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . 0.482 ' O ' HD11 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -57.5 -34.75 69.4 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.18 -0.464 . . . . 54.12 110.818 179.926 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 14.6 m95 -61.46 -50.12 74.04 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.252 -0.431 . . . . 75.23 110.906 -179.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' GLY . . . . . 0.599 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -73.08 -27.48 68.41 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.768 -0.73 . . . . 73.32 112.406 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.2 mmpt? -63.22 -15.18 56.23 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.791 0.329 . . . . 72.42 110.928 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.525 ' HG3' HG21 ' A' ' 231' ' ' ILE . 0.4 OUTLIER -107.57 14.08 26.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.189 -0.46 . . . . 75.24 110.862 -179.985 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 0.994 HD12 HD12 ' A' ' 122' ' ' LEU . 7.3 pt -147.08 155.64 47.06 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 121.668 0.747 . . . . 71.34 111.101 -180.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.76 3.7 2.62 Favored 'Trans proline' 0 C--N 1.342 0.226 0 C-N-CA 122.633 2.222 . . . . 72.21 112.391 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.994 HD12 HD12 ' A' ' 120' ' ' ILE . 4.6 mt -60.59 -155.37 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.232 -0.44 . . . . 73.22 110.981 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.632 ' HD2' HG23 ' A' ' 88' ' ' VAL . 65.9 t60 -167.81 149.0 5.31 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.266 -0.424 . . . . 74.12 110.86 179.87 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . 0.546 ' CD2' HD21 ' A' ' 113' ' ' LEU . 43.9 m-85 -129.41 148.67 51.35 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.223 -0.444 . . . . 75.54 110.841 -179.901 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.421 ' HG2' ' N ' ' A' ' 126' ' ' LYS . 0.4 OUTLIER -126.22 143.19 51.23 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.13 -0.487 . . . . 75.14 110.919 -179.971 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . 0.421 ' N ' ' HG2' ' A' ' 125' ' ' ARG . 0.0 OUTLIER -80.7 140.34 35.65 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.201 -0.454 . . . . 72.22 110.875 -179.999 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . 0.899 HG11 ' HB2' ' A' ' 132' ' ' ALA . 16.6 m -102.85 129.81 53.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.468 . . . . 50.13 111.082 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.467 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -142.31 -22.61 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.156 -0.475 . . . . 74.43 111.127 179.916 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' TRP . . . . . 0.467 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -139.01 109.18 6.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.146 -0.479 . . . . 71.25 110.88 -179.975 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 108.43 -160.73 13.61 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.711 -0.757 . . . . 62.11 112.466 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -102.0 155.56 18.09 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.795 0.331 . . . . 63.25 111.139 -179.862 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . 0.899 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -112.23 165.47 12.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.201 -0.454 . . . . 51.34 111.057 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -71.53 -58.22 3.7 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.176 -0.466 . . . . 75.41 110.842 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . 0.418 HG22 ' CD1' ' A' ' 136' ' ' ILE . 16.8 mm -85.11 107.96 16.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.226 -0.443 . . . . 70.51 111.123 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 8.4 mmm -95.29 121.0 36.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.152 -0.477 . . . . 72.43 110.869 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.418 ' CD1' HG22 ' A' ' 134' ' ' ILE . 0.7 OUTLIER -106.9 97.79 6.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.306 -0.407 . . . . 70.04 111.099 -179.997 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . 0.407 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -129.36 165.96 21.83 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.725 -0.75 . . . . 63.34 112.533 179.867 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 138' ' ' PHE . . . . . 0.557 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 82.4 m-85 -105.27 141.45 36.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.859 0.362 . . . . 74.01 110.893 -179.846 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.557 ' HB2' ' O ' ' A' ' 138' ' ' PHE . . . 170.24 165.84 0.06 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.119 -0.491 . . . . 71.21 111.092 179.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.42 ' HB2' ' HB3' ' A' ' 149' ' ' PHE . 7.2 ptt180 -105.99 174.08 6.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.194 -0.457 . . . . 62.21 110.849 -179.888 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . 0.536 ' H ' ' HA ' ' A' ' 149' ' ' PHE . . . -55.71 -16.76 12.44 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.716 -0.754 . . . . 74.24 112.46 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 142' ' ' ALA . . . . . 0.618 ' HB2' ' CD2' ' A' ' 149' ' ' PHE . . . -91.84 13.12 19.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.86 0.362 . . . . 75.03 111.117 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 143' ' ' HIS . . . . . 0.482 ' HB3' ' HB1' ' A' ' 139' ' ' ALA . 4.3 p80 -79.21 -2.07 39.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.199 -0.455 . . . . 71.11 110.86 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 107.92 49.1 0.85 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.751 -0.738 . . . . 45.51 112.523 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -163.59 174.59 11.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.848 0.356 . . . . 72.14 110.802 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 47.1 p -63.9 -179.61 0.42 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.172 -0.467 . . . . 51.25 110.853 -179.781 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 65.34 119.97 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.627 0.727 . . . . 73.4 110.955 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.8 141.41 45.02 Favored 'Trans proline' 0 C--O 1.232 0.186 0 C-N-CA 122.734 2.29 . . . . 74.53 112.328 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 149' ' ' PHE . . . . . 0.618 ' CD2' ' HB2' ' A' ' 142' ' ' ALA . 3.4 p90 -54.23 -40.71 67.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.275 -0.421 . . . . 63.52 110.879 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . 0.482 ' CG ' ' O ' ' A' ' 149' ' ' PHE . 2.8 p30 49.16 19.19 0.28 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.106 -0.497 . . . . 63.11 110.891 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . 0.423 ' C ' ' O ' ' A' ' 150' ' ' ASP . . . 35.97 -147.53 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.785 -0.721 . . . . 71.41 112.495 -179.942 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.68 145.27 57.09 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.721 2.28 . . . . 75.11 112.325 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . 0.456 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 106.45 -138.99 14.67 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.803 -0.713 . . . . 70.32 112.52 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 154' ' ' ASN . . . . . 0.456 ' C ' ' O ' ' A' ' 153' ' ' GLY . 3.7 p30 -33.8 136.05 0.12 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.896 0.379 . . . . 73.25 110.88 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 155' ' ' THR . . . . . 0.417 HG23 ' HA2' ' A' ' 68' ' ' GLY . 0.6 OUTLIER 77.19 115.91 0.06 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.2 -0.455 . . . . 44.41 111.114 -179.964 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 156' ' ' LEU . . . . . 0.993 HD21 HG21 ' A' ' 186' ' ' ILE . 0.6 OUTLIER -94.53 -53.39 3.92 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.209 -0.45 . . . . 75.02 110.894 179.961 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . 0.558 ' HB1' ' O ' ' A' ' 171' ' ' HIS . . . -163.97 149.32 10.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.178 -0.464 . . . . 71.42 111.069 179.818 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 29.3 p-80 -109.13 123.6 49.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.256 -0.429 . . . . 72.02 110.903 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -110.54 152.6 26.19 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.248 -0.433 . . . . 74.42 111.067 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -108.01 169.85 8.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.191 -0.459 . . . . 75.31 110.862 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 161' ' ' ALA . . . . . 0.706 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -107.98 164.23 15.23 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-O 121.624 0.726 . . . . 61.04 111.149 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 162' ' ' PRO . . . . . 0.706 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.9 Cg_endo -69.86 90.06 0.53 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.688 2.259 . . . . 74.44 112.315 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -144.43 141.72 10.36 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.779 -0.724 . . . . 61.41 112.514 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 74.3 m 64.79 -81.31 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.82 0.343 . . . . 73.1 111.135 -179.834 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -179.52 -70.19 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.721 -0.752 . . . . 74.03 112.489 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 166' ' ' LEU . . . . . 0.799 HD22 ' C ' ' A' ' 166' ' ' LEU . 0.0 OUTLIER -54.0 -21.57 8.49 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.815 0.341 . . . . 65.12 110.848 -179.9 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . 0.727 ' N ' HD22 ' A' ' 166' ' ' LEU . . . -80.38 -173.84 46.91 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.732 -0.747 . . . . 43.43 112.543 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 72.8 22.26 79.18 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.775 -0.726 . . . . 74.31 112.444 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -95.93 -174.21 3.05 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.798 0.333 . . . . 63.41 110.858 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -124.71 131.42 53.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.128 -0.487 . . . . 74.21 111.064 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 171' ' ' HIS . . . . . 0.558 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 18.8 m170 -125.92 132.37 52.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.206 -0.452 . . . . 72.53 110.882 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 -114.35 140.26 48.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.195 -0.457 . . . . 71.44 110.911 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 57.8 t0 -73.43 101.59 3.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.138 -0.483 . . . . 74.11 110.881 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.34 -16.21 13.51 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.16 -0.473 . . . . 72.25 110.876 -179.892 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -79.11 -16.16 57.1 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.123 -0.49 . . . . 73.32 110.796 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 37.8 mm-40 -83.61 -175.88 6.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.262 -0.427 . . . . 63.2 110.922 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 54.4 mtm180 -111.59 116.86 31.52 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.225 -0.443 . . . . 63.14 110.881 -179.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 52.1 m95 -116.96 139.89 50.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.203 -0.453 . . . . 72.31 110.959 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 179' ' ' THR . . . . . 0.442 HG21 ' HB3' ' A' ' 182' ' ' SER . 12.7 t -178.11 163.5 1.71 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.236 -0.438 . . . . 74.13 111.142 -179.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -125.32 -70.13 0.76 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.29 -0.413 . . . . 45.33 110.946 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -62.83 -13.57 47.67 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.784 -0.722 . . . . 62.41 112.5 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 182' ' ' SER . . . . . 0.442 ' HB3' HG21 ' A' ' 179' ' ' THR . 0.4 OUTLIER -93.58 -24.41 17.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.859 0.361 . . . . 64.5 110.806 -179.677 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 183' ' ' SER . . . . . 0.422 ' C ' ' O ' ' A' ' 182' ' ' SER . 4.5 m 35.67 57.61 0.9 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.127 -0.488 . . . . 64.12 110.824 -179.776 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 184' ' ' LEU . . . . . 0.408 ' O ' HD23 ' A' ' 184' ' ' LEU . 4.2 tt -116.86 -33.62 4.72 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.124 -0.489 . . . . 74.2 110.837 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -117.99 -140.22 6.43 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.809 -0.71 . . . . 73.01 112.528 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 186' ' ' ILE . . . . . 0.993 HG21 HD21 ' A' ' 156' ' ' LEU . 5.5 mm -79.65 98.58 3.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 120.873 0.368 . . . . 73.22 111.149 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -47.09 120.52 3.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.15 -0.477 . . . . 71.31 110.892 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 188' ' ' PHE . . . . . 0.746 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.4 t80 -54.07 -35.41 62.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.137 -0.483 . . . . 75.45 110.902 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . 0.593 HD12 ' CD2' ' A' ' 224' ' ' PHE . 0.2 OUTLIER -67.11 -48.0 69.47 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.077 -0.51 . . . . 52.02 110.946 -179.95 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -70.22 -40.23 74.63 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.152 -0.476 . . . . 74.22 110.906 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 191' ' ' ALA . . . . . 0.67 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -70.62 -35.07 72.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.143 -0.48 . . . . 50.03 111.08 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 192' ' ' ALA . . . . . 0.6 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -56.62 -44.62 81.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.246 -0.433 . . . . 52.11 111.114 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 193' ' ' THR . . . . . 0.504 HG21 ' HE1' ' A' ' 224' ' ' PHE . 0.2 OUTLIER -58.47 -42.37 87.34 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.285 -0.416 . . . . 72.43 111.109 -179.931 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 14.5 t-160 -73.36 -42.06 62.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.263 -0.426 . . . . 71.44 110.755 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -72.09 -48.59 42.91 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.299 -0.409 . . . . 71.01 111.132 179.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 196' ' ' LEU . . . . . 0.82 HD12 ' CD1' ' A' ' 113' ' ' LEU . 4.4 mm? -65.73 -43.45 88.99 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.218 -0.447 . . . . 74.51 110.965 -179.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -57.34 -28.37 59.04 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.68 -0.771 . . . . 52.23 112.527 179.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 198' ' ' HIS . . . . . 0.622 ' CD2' HG21 ' A' ' 69' ' ' VAL . 6.1 m-70 -65.87 -32.84 74.58 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.777 0.322 . . . . 75.21 110.88 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -69.77 -20.84 63.47 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.265 -0.425 . . . . 71.13 110.847 -179.802 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 200' ' ' LEU . . . . . 0.425 ' HA ' ' CD1' ' A' ' 84' ' ' TRP . 0.3 OUTLIER -89.78 5.56 45.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.139 -0.482 . . . . 64.13 110.916 -179.98 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 83.6 -7.52 68.82 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.704 -0.76 . . . . 50.41 112.577 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 202' ' ' MET . . . . . . . . . . . . . 45.4 tpp -55.27 135.24 49.99 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.797 0.332 . . . . 63.21 110.853 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -113.53 158.94 13.97 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.75 -0.738 . . . . 64.44 112.465 -179.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 204' ' ' HIS . . . . . 0.404 ' HA ' ' HG3' ' A' ' 212' ' ' MET . 11.2 m170 -55.15 150.76 10.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.793 0.33 . . . . 74.32 110.86 -179.92 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -117.51 162.57 17.76 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.149 -0.478 . . . . 53.34 110.84 -179.751 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 206' ' ' SER . . . . . 0.434 ' HB2' ' HA2' ' A' ' 47' ' ' GLY . 2.0 p -88.36 -4.0 58.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.089 -0.505 . . . . 72.22 110.879 -179.803 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -70.89 134.89 85.58 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.645 0.736 . . . . 65.11 110.825 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.85 -6.1 17.85 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.631 2.22 . . . . 74.53 112.362 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 -126.65 33.42 4.97 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.217 -0.447 . . . . 63.52 110.902 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 210' ' ' ALA . . . . . 0.454 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.28 145.77 26.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.148 -0.478 . . . . 62.23 111.063 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -73.31 -25.91 21.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.222 -0.445 . . . . 62.04 111.122 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 212' ' ' MET . . . . . 0.404 ' HG3' ' HA ' ' A' ' 204' ' ' HIS . 0.0 OUTLIER -99.68 8.7 44.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.222 -0.444 . . . . 75.22 110.849 179.908 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 213' ' ' TYR . . . . . 0.449 ' CD1' ' HD2' ' A' ' 214' ' ' PRO . 0.3 OUTLIER -55.31 128.13 66.21 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.679 0.752 . . . . 73.43 110.955 -179.927 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 214' ' ' PRO . . . . . 0.449 ' HD2' ' CD1' ' A' ' 213' ' ' TYR . 54.2 Cg_endo -69.72 -18.54 37.13 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.738 2.292 . . . . 63.01 112.417 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 2.2 p -84.38 48.3 1.48 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.153 -0.476 . . . . 74.24 111.146 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 10.9 t80 . . . . . 0 C--N 1.327 -0.392 0 CA-C-N 116.235 -0.439 . . . . 74.14 110.959 -179.95 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 224' ' ' PHE . . . . . 0.593 ' CD2' HD12 ' A' ' 189' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.888 0.375 . . . . 65.01 110.899 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.64 159.61 42.15 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.182 -0.463 . . . . 64.24 110.919 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 226' ' ' LEU . . . . . 0.63 ' HB3' HD11 ' A' ' 231' ' ' ILE . 24.6 mt -60.21 149.12 34.05 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.287 -0.415 . . . . 53.44 110.882 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 227' ' ' SER . . . . . 0.454 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 1.0 OUTLIER -86.78 152.25 22.67 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.23 -0.441 . . . . 74.21 110.9 -179.927 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -65.19 -68.31 0.37 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.171 -0.468 . . . . 74.54 110.925 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -55.38 -24.97 32.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.174 -0.466 . . . . 72.22 110.826 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 4.9 t0 -69.51 -49.24 56.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.176 -0.465 . . . . 74.23 110.895 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 231' ' ' ILE . . . . . 0.63 HD11 ' HB3' ' A' ' 226' ' ' LEU . 9.2 mt -68.56 -42.63 83.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.203 -0.453 . . . . 73.41 111.211 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 232' ' ' LYS . . . . . 0.41 ' HG3' ' N ' ' A' ' 233' ' ' GLY . 0.2 OUTLIER -59.7 -32.08 70.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.084 -0.507 . . . . 65.42 110.915 179.844 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 233' ' ' GLY . . . . . 0.41 ' N ' ' HG3' ' A' ' 232' ' ' LYS . . . -69.02 -47.11 56.36 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.717 -0.754 . . . . 63.43 112.546 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 13.5 tt -72.59 -30.64 34.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.81 0.338 . . . . 71.54 111.147 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -66.82 -24.56 66.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.108 -0.496 . . . . 70.33 110.975 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 236' ' ' LYS . . . . . 0.472 ' HE3' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.16 -23.1 59.2 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.174 -0.466 . . . . 51.21 110.918 179.929 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 237' ' ' LEU . . . . . 0.683 HD13 ' CD ' ' A' ' 83' ' ' LYS . 10.5 tt -97.24 -38.41 9.69 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.202 -0.454 . . . . 75.41 110.926 179.869 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 238' ' ' TYR . . . . . . . . . . . . . 62.7 m-85 -92.35 -2.66 56.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 51.24 110.914 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.302 0 C-N-CA 120.734 -0.746 . . . . 32.22 112.431 179.946 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 19.0 t-105 . . . . . 0 C--O 1.23 0.057 0 CA-C-O 120.745 0.307 . . . . 71.22 110.958 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 62.5 mt-10 -73.41 -35.47 65.85 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.214 -0.448 . . . . 72.51 110.886 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -63.0 -40.97 99.39 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.139 -0.482 . . . . 61.24 110.939 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.658 ' HB1' ' HE3' ' A' ' 62' ' ' MET . . . -61.78 -41.86 98.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.192 -0.458 . . . . 54.34 111.057 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -66.06 -43.15 88.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 73.12 110.9 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -71.07 -31.48 67.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.173 -0.467 . . . . 72.4 110.893 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -70.22 -35.8 74.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.149 -0.478 . . . . 75.11 110.917 -179.805 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.645 HD13 ' O ' ' A' ' 19' ' ' LEU . 3.2 tm? -67.21 -26.24 66.51 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.162 -0.472 . . . . 72.51 110.921 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.407 ' HG2' ' N ' ' A' ' 21' ' ' ARG . 6.3 ptmt -69.43 -32.64 71.73 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.145 -0.48 . . . . 74.41 110.895 179.837 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.407 ' N ' ' HG2' ' A' ' 20' ' ' LYS . 5.3 ptp180 -86.75 -27.62 23.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.213 -0.449 . . . . 74.05 110.905 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.95 -24.29 64.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.162 -0.472 . . . . 74.31 110.955 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.55 ' O ' ' HB3' ' A' ' 70' ' ' PRO . 19.2 m-85 . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.123 -0.489 . . . . 72.55 110.916 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.436 ' O ' HD13 ' A' ' 39' ' ' LEU . 0.8 OUTLIER . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.76 0.315 . . . . 72.52 110.953 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -64.25 -51.34 64.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.21 -0.45 . . . . 73.13 110.886 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.82 -47.85 81.63 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.101 -0.5 . . . . 63.32 111.064 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 2.4 tttp -60.17 -38.62 83.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.281 -0.418 . . . . 72.32 110.931 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.7 HD21 ' HB2' ' A' ' 54' ' ' LEU . 0.9 OUTLIER -54.6 -36.68 64.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.208 -0.451 . . . . 72.11 110.911 179.902 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.1 ttpp -58.89 -45.72 89.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.183 -0.462 . . . . 62.43 110.914 179.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -69.79 -37.34 76.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.22 -0.446 . . . . 75.11 110.908 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.444 ' CE ' HD11 ' A' ' 61' ' ' ILE . 6.7 ttt -68.6 -40.29 80.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.106 -0.497 . . . . 63.43 110.907 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.753 ' HG2' HD11 ' A' ' 48' ' ' LEU . 27.1 mt-30 -65.94 -42.36 90.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.241 -0.436 . . . . 74.45 110.889 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.0 mmpt? -63.37 -28.47 70.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.171 -0.468 . . . . 71.43 110.876 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 15.0 t80 -69.8 -36.84 76.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.218 -0.447 . . . . 73.32 110.915 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.59 ' CZ ' HD12 ' A' ' 61' ' ' ILE . 10.2 m-85 -81.2 -35.24 31.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.165 -0.471 . . . . 70.43 110.907 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 102.79 -6.11 51.6 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.733 -0.746 . . . . 64.34 112.465 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.753 HD11 ' HG2' ' A' ' 43' ' ' GLN . 0.6 OUTLIER -59.71 143.13 87.3 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.593 0.711 . . . . 64.11 110.962 -179.932 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.66 -53.92 0.25 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.712 2.275 . . . . 74.5 112.358 179.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.71 HD13 ' OG ' ' A' ' 56' ' ' SER . 0.7 OUTLIER -51.58 108.09 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.146 -0.479 . . . . 71.22 111.157 179.939 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -109.61 160.63 16.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.257 -0.429 . . . . 73.25 111.128 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 57.67 18.51 31.61 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.815 -0.707 . . . . 64.24 112.483 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 10.1 mtt -124.76 161.14 27.07 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.753 0.311 . . . . 75.23 110.885 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.7 ' HB2' HD21 ' A' ' 39' ' ' LEU . 20.1 tp -157.87 96.5 1.49 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.186 -0.461 . . . . 73.4 110.855 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.414 ' HA ' HG13 ' A' ' 59' ' ' ILE . 0.7 OUTLIER 174.77 -29.06 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.192 -0.458 . . . . 44.35 110.87 179.892 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . 0.71 ' OG ' HD13 ' A' ' 50' ' ' ILE . 2.5 p -85.08 -99.63 0.06 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.155 -0.475 . . . . 75.25 110.876 -179.83 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -84.84 -30.5 24.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.139 -0.482 . . . . 61.22 110.866 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.44 HG23 HD12 ' A' ' 50' ' ' ILE . 41.9 t -59.33 -43.75 90.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.193 -0.458 . . . . 70.12 111.144 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.414 HG13 ' HA ' ' A' ' 55' ' ' ASN . 2.9 mm -75.05 -31.33 24.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.172 -0.467 . . . . 74.43 111.1 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -66.1 -44.21 85.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.165 -0.471 . . . . 73.45 110.869 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.59 HD12 ' CZ ' ' A' ' 46' ' ' PHE . 35.5 pt -66.29 -29.78 47.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.115 -0.493 . . . . 74.52 111.143 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . 0.658 ' HE3' ' HB1' ' A' ' 15' ' ' ALA . 1.4 mmm -71.18 -33.2 69.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.166 -0.47 . . . . 74.01 110.885 179.836 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -88.09 -25.66 22.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.199 -0.455 . . . . 42.22 110.896 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.01 137.69 37.47 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.573 0.702 . . . . 65.34 110.897 179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -69.79 113.2 3.3 Favored 'Trans proline' 0 C--O 1.232 0.217 0 C-N-CA 122.66 2.24 . . . . 72.11 112.349 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 4.6 ttm180 -106.87 -85.75 0.5 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.296 -0.411 . . . . 71.51 110.873 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -145.86 156.31 43.47 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.19 -0.459 . . . . 55.3 110.848 -179.929 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.562 ' HA2' HG23 ' A' ' 155' ' ' THR . . . -96.63 16.78 60.43 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.739 -0.743 . . . . 64.23 112.468 -179.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.453 HG21 ' CD2' ' A' ' 198' ' ' HIS . 0.0 OUTLIER -111.85 133.15 21.66 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.604 0.716 . . . . 74.23 111.091 -179.927 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . 0.55 ' HB3' ' O ' ' A' ' 23' ' ' TYR . 54.1 Cg_endo -69.7 165.73 29.92 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.66 2.24 . . . . 63.44 112.367 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -120.52 38.51 3.98 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.234 -0.439 . . . . 74.45 110.859 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.167 -0.47 . . . . 53.43 111.102 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo . . . . . 0 C--O 1.232 0.191 0 CA-C-O 120.859 0.275 . . . . 71.11 112.332 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.971 ' HD2' HD23 ' A' ' 237' ' ' LEU . 0.3 OUTLIER -89.61 165.34 14.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.237 -0.438 . . . . 64.45 110.855 179.929 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . 0.493 ' CD1' ' HA ' ' A' ' 200' ' ' LEU . 24.5 m95 -55.86 123.57 14.69 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.153 -0.476 . . . . 73.31 110.91 179.868 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -115.16 1.35 13.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.243 -0.435 . . . . 65.3 111.109 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -69.63 163.25 25.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.198 -0.455 . . . . 70.34 110.849 -179.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.92 -7.21 57.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.153 -0.476 . . . . 71.12 110.837 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.436 HG23 ' CD2' ' A' ' 123' ' ' HIS . 0.3 OUTLIER -172.76 139.21 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.231 -0.441 . . . . 74.14 111.197 179.859 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 13.3 t -122.51 129.59 75.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 72.25 111.091 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.725 HG22 ' HB3' ' A' ' 125' ' ' ARG . 5.0 p -116.99 168.22 10.44 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.169 -0.468 . . . . 71.01 111.144 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.413 ' CD1' ' N ' ' A' ' 91' ' ' TYR . 2.5 p90 -145.26 146.56 31.72 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.259 -0.428 . . . . 70.51 110.909 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.416 ' O ' ' HA ' ' A' ' 135' ' ' MET . 3.4 ttt180 -147.04 132.09 18.23 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.148 -0.478 . . . . 71.25 110.831 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 3.9 mp -74.67 134.97 28.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.155 -0.475 . . . . 72.4 111.113 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.556 HG22 ' CE ' ' A' ' 135' ' ' MET . 11.2 t -93.96 -40.63 11.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.198 -0.456 . . . . 60.2 111.163 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 1.4 t -139.45 164.03 30.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.136 -0.484 . . . . 64.24 110.881 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 11.2 p90 -113.54 152.52 30.12 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.115 -0.493 . . . . 72.25 110.911 -179.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.471 ' OG1' HG21 ' A' ' 105' ' ' VAL . 0.2 OUTLIER -82.74 141.02 32.7 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.126 -0.488 . . . . 64.11 111.119 -179.931 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 4.4 ppt_? -74.15 -7.08 51.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.243 -0.435 . . . . 72.14 110.868 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -96.4 -26.47 15.32 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.181 -0.463 . . . . 74.13 110.82 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.567 HD21 ' HA ' ' A' ' 179' ' ' THR . 0.6 OUTLIER -133.84 153.68 80.06 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-O 121.543 0.687 . . . . 72.52 110.954 -179.928 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . 0.585 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.9 Cg_endo -69.76 150.89 68.82 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.696 2.264 . . . . 73.11 112.322 179.82 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 16.0 t-160 -52.22 -26.21 11.14 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.138 -0.483 . . . . 74.11 110.825 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.585 HG22 ' HB2' ' A' ' 101' ' ' PRO . 13.9 tt -76.8 -39.2 30.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.199 -0.455 . . . . 74.02 111.122 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . 0.67 ' O ' HD22 ' A' ' 108' ' ' LEU . 3.4 m -69.46 -38.56 77.81 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.141 -0.481 . . . . 52.11 111.141 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.744 ' O ' HG13 ' A' ' 109' ' ' VAL . 98.7 t -72.7 -45.08 58.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.275 -0.421 . . . . 71.51 111.152 179.88 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.645 ' O ' HG22 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -64.72 -42.42 95.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.21 -0.45 . . . . 63.44 110.823 179.931 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 13.8 ptm180 -70.14 -34.06 72.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.179 -0.464 . . . . 75.02 110.835 -179.842 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.67 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -61.0 -48.84 79.95 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.221 -0.445 . . . . 71.04 110.961 179.95 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.744 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.4 m -55.78 -41.66 66.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.204 -0.453 . . . . 72.31 111.082 179.867 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.471 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 13.5 t -70.1 -34.29 72.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.19 -0.459 . . . . 72.14 110.845 -179.841 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.463 ' CG ' HD21 ' A' ' 189' ' ' LEU . 0.5 OUTLIER -62.44 -33.53 75.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.164 -0.471 . . . . 74.35 110.928 179.912 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -94.68 -40.2 9.93 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.165 -0.47 . . . . 74.32 111.068 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.714 ' CD1' HD12 ' A' ' 196' ' ' LEU . 0.4 OUTLIER -64.86 -33.11 75.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.224 -0.444 . . . . 72.0 110.926 -179.974 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -65.68 -36.4 83.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.164 -0.471 . . . . 72.34 110.887 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . 0.746 ' O ' HD11 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -64.58 -34.48 78.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.174 -0.466 . . . . 54.12 110.892 179.932 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' TRP . . . . . 0.622 ' O ' ' HG3' ' A' ' 119' ' ' GLU . 6.9 m95 -64.24 -49.48 71.77 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.199 -0.455 . . . . 75.23 110.946 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' GLY . . . . . 0.567 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -74.79 -19.41 79.92 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.802 -0.713 . . . . 73.32 112.45 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 5.6 mtmt -70.53 -14.01 62.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.739 0.304 . . . . 72.42 110.933 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.638 ' OE1' HG23 ' A' ' 120' ' ' ILE . 2.3 pp20? -109.97 12.45 23.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.243 -0.435 . . . . 75.24 110.877 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 1.082 HD12 HD12 ' A' ' 122' ' ' LEU . 4.7 pt -144.25 142.98 20.69 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.64 0.733 . . . . 71.34 111.133 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 16.57 0.21 Allowed 'Trans proline' 0 C--O 1.233 0.268 0 C-N-CA 122.723 2.282 . . . . 72.21 112.33 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 1.082 HD12 HD12 ' A' ' 120' ' ' ILE . 5.2 mt -62.54 -158.07 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.301 -0.409 . . . . 73.22 110.908 -179.981 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.436 ' CD2' HG23 ' A' ' 88' ' ' VAL . 3.4 t-160 -156.47 121.06 4.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.196 -0.456 . . . . 74.12 110.886 179.796 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 11.6 m-30 -109.88 148.69 31.09 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.205 -0.452 . . . . 75.54 110.905 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.725 ' HB3' HG22 ' A' ' 90' ' ' THR . 0.0 OUTLIER -132.03 142.16 49.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.105 -0.498 . . . . 75.14 110.852 -179.878 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . 0.457 ' HE3' HG13 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -80.03 149.35 30.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.187 -0.46 . . . . 72.22 110.957 179.909 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . 1.025 HG11 ' HB2' ' A' ' 132' ' ' ALA . 26.5 m -103.13 126.14 57.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.195 -0.457 . . . . 50.13 111.087 179.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.608 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -142.98 -9.81 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.204 -0.453 . . . . 74.43 111.157 179.885 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' TRP . . . . . 0.608 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -157.31 108.97 2.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.164 -0.471 . . . . 71.25 110.936 179.96 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 109.1 -159.7 13.93 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.727 -0.749 . . . . 62.11 112.512 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 23.7 p -101.96 156.11 17.74 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.821 0.343 . . . . 63.25 111.153 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . 1.025 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -111.97 165.32 12.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.26 -0.427 . . . . 51.34 111.06 179.873 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . 0.466 ' HB2' HD12 ' A' ' 134' ' ' ILE . 3.0 m-20 -70.03 -65.37 0.73 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.137 -0.483 . . . . 75.41 110.877 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . 0.491 HD12 ' N ' ' A' ' 134' ' ' ILE . 3.9 mp -88.71 106.74 17.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.218 -0.446 . . . . 70.51 111.145 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . 0.556 ' CE ' HG22 ' A' ' 94' ' ' VAL . 0.9 OUTLIER -91.49 128.36 37.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.219 -0.446 . . . . 72.43 110.897 179.838 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.458 ' CD1' HG22 ' A' ' 134' ' ' ILE . 0.5 OUTLIER -106.01 97.6 5.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.302 -0.408 . . . . 70.04 111.1 -179.986 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . 0.4 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -130.18 157.73 22.09 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.727 -0.749 . . . . 63.34 112.479 179.932 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 138' ' ' PHE . . . . . 0.616 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 2.7 m-85 -105.12 147.5 27.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.88 0.371 . . . . 74.01 110.89 -179.844 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.616 ' HB2' ' O ' ' A' ' 138' ' ' PHE . . . 166.81 166.56 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.196 -0.456 . . . . 71.21 111.102 179.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 47.4 mtm180 -104.74 173.06 6.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.205 -0.452 . . . . 62.21 110.867 -179.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -55.02 -20.73 21.4 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.793 -0.718 . . . . 74.24 112.46 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -65.42 -13.57 59.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.818 0.342 . . . . 75.03 111.136 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 2.0 p80 -68.65 -11.13 59.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 71.11 110.917 179.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 116.06 39.41 0.88 Allowed Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.752 -0.737 . . . . 45.51 112.468 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -117.91 142.84 46.89 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.755 0.312 . . . . 72.14 110.838 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 52.8 p -65.28 153.73 40.24 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 51.25 110.883 -179.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 64.88 134.61 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.674 0.75 . . . . 73.4 110.912 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.67 134.62 28.61 Favored 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.7 2.267 . . . . 74.53 112.362 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -69.21 -32.22 71.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.288 -0.414 . . . . 63.52 110.862 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 74.23 -1.45 3.07 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.119 -0.491 . . . . 63.11 110.835 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 51.04 -111.12 1.16 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.737 -0.744 . . . . 71.41 112.474 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.8 139.96 41.36 Favored 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.641 2.227 . . . . 75.11 112.378 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 103.5 -154.38 17.96 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.744 -0.741 . . . . 70.32 112.445 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -41.41 153.17 0.05 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.875 0.369 . . . . 73.25 110.864 -179.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 155' ' ' THR . . . . . 0.562 HG23 ' HA2' ' A' ' 68' ' ' GLY . 0.2 OUTLIER 77.31 108.07 0.08 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.236 -0.438 . . . . 44.41 111.136 -179.993 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 156' ' ' LEU . . . . . 1.014 HD21 HG21 ' A' ' 186' ' ' ILE . 0.5 OUTLIER -90.83 -53.49 4.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 75.02 110.93 179.953 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . 0.544 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -165.44 148.14 7.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.133 -0.485 . . . . 71.42 111.067 179.809 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 20.0 p-80 -105.75 123.8 48.53 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.156 -0.475 . . . . 72.02 110.903 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -111.33 154.04 25.13 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.274 -0.421 . . . . 74.42 111.094 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 17.7 m-85 -106.8 146.99 30.22 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.202 -0.454 . . . . 75.31 110.845 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 161' ' ' ALA . . . . . 0.707 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -78.47 164.51 55.67 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 121.631 0.729 . . . . 61.04 111.015 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 162' ' ' PRO . . . . . 0.707 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.3 Cg_endo -69.77 78.12 1.03 Allowed 'Trans proline' 0 C--N 1.343 0.237 0 C-N-CA 122.734 2.29 . . . . 74.44 112.299 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -137.81 114.62 1.11 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.692 -0.766 . . . . 61.41 112.447 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 66.64 168.39 0.23 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.864 0.364 . . . . 73.1 111.143 -179.875 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -64.64 -48.17 75.69 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.695 -0.764 . . . . 74.03 112.474 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 166' ' ' LEU . . . . . 0.461 ' C ' HD23 ' A' ' 166' ' ' LEU . 10.1 tt -62.7 -40.01 95.81 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.846 0.355 . . . . 65.12 110.916 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -79.35 163.16 48.45 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.739 -0.743 . . . . 43.43 112.454 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 89.88 22.72 35.12 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.686 -0.769 . . . . 74.31 112.457 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -91.98 161.65 14.71 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.769 0.319 . . . . 63.41 110.888 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.38 130.46 55.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.231 -0.441 . . . . 74.21 111.076 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 4.8 m170 -126.61 158.46 36.24 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.198 -0.455 . . . . 72.53 110.826 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 58.8 m-85 -140.93 138.84 34.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.151 -0.477 . . . . 71.44 110.868 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 66.7 t0 -70.39 96.77 1.18 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.155 -0.475 . . . . 74.11 110.884 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 2.2 pp20? -57.87 -16.62 12.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.174 -0.467 . . . . 72.25 110.878 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -79.43 -16.4 56.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.145 -0.48 . . . . 73.32 110.814 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 25.1 mm-40 -79.78 -174.91 4.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.262 -0.426 . . . . 63.2 110.839 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 39.6 mtm180 -111.23 111.17 22.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.128 -0.487 . . . . 63.14 110.874 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 12.5 m95 -117.13 145.03 44.06 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.253 -0.43 . . . . 72.31 110.953 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 179' ' ' THR . . . . . 0.57 HG21 ' HB3' ' A' ' 182' ' ' SER . 7.2 t -178.58 163.79 1.55 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.265 -0.425 . . . . 74.13 111.079 -179.914 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -123.09 -68.21 0.9 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 45.33 110.902 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -66.99 -10.83 57.23 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.761 -0.733 . . . . 62.41 112.479 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 182' ' ' SER . . . . . 0.57 ' HB3' HG21 ' A' ' 179' ' ' THR . 0.3 OUTLIER -97.36 -24.44 15.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.763 0.316 . . . . 64.5 110.802 -179.71 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 183' ' ' SER . . . . . 0.449 ' C ' ' O ' ' A' ' 182' ' ' SER . 1.3 m 32.93 61.69 0.38 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.178 -0.465 . . . . 64.12 110.826 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -116.82 -33.66 4.72 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.196 -0.456 . . . . 74.2 110.928 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -121.66 -135.38 4.74 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.743 -0.742 . . . . 73.01 112.486 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 186' ' ' ILE . . . . . 1.014 HG21 HD21 ' A' ' 156' ' ' LEU . 8.5 mm -79.41 97.58 2.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.784 0.326 . . . . 73.22 111.113 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -50.87 123.46 9.18 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.193 -0.458 . . . . 71.31 110.846 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 188' ' ' PHE . . . . . 0.731 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.5 t80 -54.27 -36.55 63.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.144 -0.48 . . . . 75.45 110.821 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . 0.481 HD12 ' CE2' ' A' ' 224' ' ' PHE . 0.0 OUTLIER -67.43 -47.55 69.88 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.189 -0.459 . . . . 52.02 110.922 -179.958 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 40.4 t80 -69.37 -39.28 78.15 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.222 -0.445 . . . . 74.22 110.874 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 191' ' ' ALA . . . . . 0.725 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -71.64 -35.49 70.42 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.122 -0.49 . . . . 50.03 111.091 179.858 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 192' ' ' ALA . . . . . 0.668 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -56.48 -44.91 81.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.214 -0.448 . . . . 52.11 111.103 179.905 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.4 -41.75 90.18 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.2 -0.455 . . . . 72.43 111.193 -179.88 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 18.1 t-160 -72.7 -39.7 66.78 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.195 -0.457 . . . . 71.44 110.843 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -75.02 -48.1 25.77 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.215 -0.448 . . . . 71.01 111.077 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 196' ' ' LEU . . . . . 0.714 HD12 ' CD1' ' A' ' 113' ' ' LEU . 4.5 mm? -62.22 -39.04 91.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.199 -0.455 . . . . 74.51 110.885 -179.892 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -61.24 -26.54 66.18 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.736 -0.745 . . . . 52.23 112.485 179.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 198' ' ' HIS . . . . . 0.453 ' CD2' HG21 ' A' ' 69' ' ' VAL . 6.9 m-70 -70.06 -32.21 70.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.831 0.348 . . . . 75.21 110.856 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -71.72 -21.25 61.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.199 -0.455 . . . . 71.13 110.823 -179.754 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 200' ' ' LEU . . . . . 0.493 ' HA ' ' CD1' ' A' ' 84' ' ' TRP . 0.3 OUTLIER -93.08 -2.44 55.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.154 -0.475 . . . . 64.13 110.974 179.988 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 90.55 -9.5 77.41 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.731 -0.747 . . . . 50.41 112.509 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 202' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.91 129.41 26.8 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.82 0.343 . . . . 63.21 110.858 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -101.02 159.37 18.9 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.734 -0.746 . . . . 64.44 112.451 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 17.5 m-70 -55.93 167.38 0.6 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.774 0.321 . . . . 74.32 110.914 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -129.32 154.14 47.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.242 -0.435 . . . . 53.34 110.873 -179.731 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -87.55 -4.64 58.97 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.178 -0.464 . . . . 72.22 110.821 -179.794 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.72 136.99 82.86 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-O 121.614 0.721 . . . . 65.11 110.927 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 -6.33 18.34 Favored 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.688 2.259 . . . . 74.53 112.375 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -128.05 30.11 5.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.23 -0.441 . . . . 63.52 110.887 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 210' ' ' ALA . . . . . 0.444 ' HA ' ' HB2' ' A' ' 227' ' ' SER . . . -87.17 145.44 26.42 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.204 -0.453 . . . . 62.23 111.122 179.84 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -68.22 -28.53 41.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.256 -0.429 . . . . 62.04 111.167 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 11.0 mtp -97.91 10.52 40.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.134 -0.484 . . . . 75.22 110.897 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 213' ' ' TYR . . . . . 0.412 ' HA ' ' HD2' ' A' ' 214' ' ' PRO . 1.9 t80 -55.56 114.35 7.17 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.638 0.732 . . . . 73.43 110.926 -179.891 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 214' ' ' PRO . . . . . 0.412 ' HD2' ' HA ' ' A' ' 213' ' ' TYR . 53.5 Cg_endo -69.78 -18.36 36.96 Favored 'Trans proline' 0 C--O 1.232 0.209 0 C-N-CA 122.687 2.258 . . . . 63.01 112.316 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 215' ' ' THR . . . . . 0.551 HG23 ' CG2' ' A' ' 61' ' ' ILE . 0.2 OUTLIER -84.24 52.29 2.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.23 -0.441 . . . . 74.24 111.068 -179.893 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 5.8 t80 . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 116.26 -0.427 . . . . 74.14 110.906 -179.972 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 224' ' ' PHE . . . . . 0.481 ' CE2' HD12 ' A' ' 189' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.956 0.408 . . . . 65.01 110.843 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -143.4 171.66 13.83 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.21 -0.45 . . . . 64.24 110.905 179.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 226' ' ' LEU . . . . . 0.746 HD11 ' O ' ' A' ' 115' ' ' MET . 25.5 mt -74.39 148.3 41.34 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.242 -0.435 . . . . 53.44 110.933 179.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 227' ' ' SER . . . . . 0.444 ' HB2' ' HA ' ' A' ' 210' ' ' ALA . 1.3 t -87.47 152.78 21.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.456 . . . . 74.21 110.873 -179.953 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 55.8 mt-30 -65.7 -64.77 0.78 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.137 -0.483 . . . . 74.54 110.928 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -55.85 -26.85 48.8 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 72.22 110.827 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -69.08 -50.06 51.69 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.192 -0.458 . . . . 74.23 110.901 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 231' ' ' ILE . . . . . 0.744 HD11 HD22 ' A' ' 226' ' ' LEU . 2.6 mm -69.93 -43.96 79.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.226 -0.443 . . . . 73.41 111.139 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 3.4 pttt -56.93 -32.69 66.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.168 -0.469 . . . . 65.42 110.847 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 233' ' ' GLY . . . . . 0.441 ' O ' ' HG3' ' A' ' 236' ' ' LYS . . . -65.52 -49.41 60.57 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.723 -0.751 . . . . 63.43 112.484 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 20.5 tt -73.77 -29.95 27.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.712 0.291 . . . . 71.54 111.075 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -62.3 -40.52 96.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.284 -0.417 . . . . 70.33 110.823 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 236' ' ' LYS . . . . . 0.444 ' HE2' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.24 -15.25 61.0 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.252 -0.431 . . . . 51.21 110.895 -179.99 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 237' ' ' LEU . . . . . 0.971 HD23 ' HD2' ' A' ' 83' ' ' LYS . 1.0 OUTLIER -96.57 -35.63 11.02 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.187 -0.46 . . . . 75.41 110.887 179.925 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 238' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -92.41 -35.58 13.6 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.221 -0.445 . . . . 51.24 110.911 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.32 0 C-N-CA 120.715 -0.755 . . . . 32.22 112.466 179.992 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.547 ' CH2' HD23 ' A' ' 54' ' ' LEU . 15.3 t-105 . . . . . 0 C--O 1.23 0.07 0 CA-C-O 120.672 0.273 . . . . 71.22 110.846 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -68.68 -35.46 77.24 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.282 -0.417 . . . . 72.51 110.939 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -62.94 -37.47 87.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.147 -0.479 . . . . 61.24 110.917 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.401 ' O ' ' HE3' ' A' ' 62' ' ' MET . . . -57.25 -40.15 77.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.209 -0.451 . . . . 54.34 111.087 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.716 ' NE2' HD12 ' A' ' 35' ' ' LEU . 0.6 OUTLIER -70.98 -42.89 69.09 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 73.12 110.955 -179.91 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -67.44 -31.61 71.9 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.182 -0.463 . . . . 72.4 110.865 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 7.4 m-85 -66.53 -41.75 88.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.224 -0.444 . . . . 75.11 110.858 -179.804 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.703 HD13 ' O ' ' A' ' 19' ' ' LEU . 2.1 tm? -71.36 -29.92 65.54 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.106 -0.497 . . . . 72.51 110.908 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.435 ' HE2' ' HA ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -61.44 -39.76 91.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.179 -0.464 . . . . 74.41 110.88 179.85 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.435 ' HA ' ' HE2' ' A' ' 20' ' ' LYS . 6.0 ptp180 -82.56 -27.72 31.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.226 -0.443 . . . . 74.05 110.911 179.957 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.0 m-30 -60.27 -15.87 28.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.189 -0.46 . . . . 74.31 110.897 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.626 ' HB3' HG21 ' A' ' 72' ' ' VAL . 8.4 m-85 . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.176 -0.465 . . . . 72.55 110.925 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.716 HD12 ' NE2' ' A' ' 16' ' ' GLN . 1.4 tt . . . . . 0 N--CA 1.458 -0.048 0 CA-C-O 120.783 0.325 . . . . 72.52 110.906 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.29 -51.41 63.65 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 73.13 110.817 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -55.3 -42.66 73.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.21 -0.45 . . . . 63.32 111.121 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.475 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.8 OUTLIER -70.38 -48.47 56.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.242 -0.436 . . . . 72.32 110.888 179.937 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.451 HD13 ' HG ' ' A' ' 35' ' ' LEU . 4.3 mp -54.41 -37.29 64.91 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.258 -0.428 . . . . 72.11 110.945 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.6 tmmt? -58.63 -45.55 89.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.181 -0.463 . . . . 62.43 110.898 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.475 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 3.0 pt-20 -60.68 -32.79 71.98 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.225 -0.443 . . . . 75.11 110.849 -179.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 9.3 ttt -68.47 -33.72 74.67 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.143 -0.48 . . . . 63.43 110.909 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.66 ' CD ' HD11 ' A' ' 48' ' ' LEU . 2.2 mm100 -61.63 -39.71 92.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.219 -0.446 . . . . 74.45 110.833 -179.888 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.2 mmpt? -71.6 -33.77 69.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.235 -0.439 . . . . 71.43 110.861 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 33.6 t80 -70.77 -40.26 72.75 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.231 -0.441 . . . . 73.32 110.94 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.861 ' CZ ' HD13 ' A' ' 61' ' ' ILE . 2.8 m-85 -81.76 -35.16 29.93 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.09 -0.505 . . . . 70.43 110.838 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 104.62 -10.08 49.05 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.719 -0.753 . . . . 64.34 112.469 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.686 HD23 ' HB3' ' A' ' 46' ' ' PHE . 0.8 OUTLIER -62.37 134.54 94.9 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.661 0.743 . . . . 64.11 110.897 -179.902 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.462 ' O ' HG23 ' A' ' 51' ' ' THR . 53.6 Cg_endo -69.76 -51.43 0.39 Allowed 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.627 2.218 . . . . 74.5 112.374 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.65 HD11 ' HG2' ' A' ' 57' ' ' ARG . 0.8 OUTLIER -49.61 108.44 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.263 -0.426 . . . . 71.22 111.189 179.895 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.462 HG23 ' O ' ' A' ' 49' ' ' PRO . 77.8 p -97.68 154.1 17.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.183 -0.462 . . . . 73.25 111.133 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 57.81 19.32 35.82 Favored Glycine 0 N--CA 1.453 -0.216 0 C-N-CA 120.724 -0.75 . . . . 64.24 112.445 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 12.8 mmt -101.43 161.12 13.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.811 0.338 . . . . 75.23 110.906 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.547 HD23 ' CH2' ' A' ' 12' ' ' TRP . 28.3 tp -172.21 84.66 0.07 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.215 -0.448 . . . . 73.4 110.884 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.3 t30 175.46 -28.86 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.134 -0.484 . . . . 44.35 110.88 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 30.9 t -89.42 -103.19 0.09 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.132 -0.486 . . . . 75.25 110.88 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.65 ' HG2' HD11 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -84.84 -25.12 28.28 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.182 -0.463 . . . . 61.22 110.956 179.99 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.474 HG22 HD13 ' A' ' 48' ' ' LEU . 46.1 t -64.05 -42.15 94.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.166 -0.47 . . . . 70.12 111.141 179.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.9 mm -75.27 -31.66 24.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.162 -0.472 . . . . 74.43 111.117 179.921 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -59.69 -44.08 93.79 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.174 -0.466 . . . . 73.45 110.9 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.861 HD13 ' CZ ' ' A' ' 46' ' ' PHE . 1.4 pp -63.05 -29.48 47.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.142 -0.481 . . . . 74.52 111.164 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . 0.401 ' HE3' ' O ' ' A' ' 15' ' ' ALA . 11.7 mmt -65.08 -36.73 85.24 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.207 -0.451 . . . . 74.01 110.808 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 15.8 pt20 -91.2 -26.25 19.14 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.306 -0.407 . . . . 42.22 110.877 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.16 125.4 70.3 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.548 0.69 . . . . 65.34 110.911 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.64 151.77 69.82 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.677 2.251 . . . . 72.11 112.351 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.14 -74.55 0.17 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.196 -0.457 . . . . 71.51 110.883 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 26.7 t -130.16 141.56 50.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.217 -0.447 . . . . 55.3 110.935 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.595 ' HA2' HG23 ' A' ' 155' ' ' THR . . . -95.16 16.36 61.47 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.794 -0.717 . . . . 64.23 112.467 -179.909 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.641 HG22 ' HD2' ' A' ' 70' ' ' PRO . 0.7 OUTLIER -125.63 145.4 51.26 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.57 0.7 . . . . 74.23 111.094 -179.927 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . 0.641 ' HD2' HG22 ' A' ' 69' ' ' VAL . 53.6 Cg_endo -69.8 -179.85 3.22 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.727 2.285 . . . . 63.44 112.353 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -133.89 22.11 3.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.251 -0.431 . . . . 74.45 110.899 179.904 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.626 HG21 ' HB3' ' A' ' 23' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.258 -0.428 . . . . 53.43 111.123 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo . . . . . 0 N--CA 1.465 -0.183 0 CA-C-O 120.867 0.278 . . . . 71.11 112.369 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.829 ' HD2' HD23 ' A' ' 237' ' ' LEU . 0.1 OUTLIER -88.83 150.48 22.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.189 -0.46 . . . . 64.45 110.883 179.925 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . 0.41 ' CD1' ' HA ' ' A' ' 200' ' ' LEU . 70.7 m95 -45.69 109.81 0.21 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.194 -0.457 . . . . 73.31 110.953 179.892 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 15.0 t -95.06 -6.65 41.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.261 -0.427 . . . . 65.3 111.17 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.1 m -65.67 177.94 1.13 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.257 -0.429 . . . . 70.34 110.856 -179.786 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 8.8 mmtp -96.26 -12.0 25.17 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.129 -0.487 . . . . 71.12 110.872 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.479 HG23 ' CD2' ' A' ' 123' ' ' HIS . 0.5 OUTLIER -156.79 142.64 9.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.261 -0.427 . . . . 74.14 111.093 179.924 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 89.9 t -115.69 130.37 70.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.187 -0.461 . . . . 72.25 111.131 179.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.412 HG22 HG13 ' A' ' 127' ' ' VAL . 0.0 OUTLIER -115.7 146.83 41.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.193 -0.458 . . . . 71.01 111.212 179.962 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 4.9 p90 -141.54 146.79 36.78 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.289 -0.414 . . . . 70.51 110.974 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 6.2 ttt180 -150.69 139.0 20.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.155 -0.475 . . . . 71.25 110.862 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.422 HD11 ' HA ' ' A' ' 106' ' ' ASP . 14.2 mm -75.13 125.35 34.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.212 -0.449 . . . . 72.4 111.116 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.657 HG22 ' SD ' ' A' ' 135' ' ' MET . 5.7 t -83.0 -40.58 16.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.139 -0.482 . . . . 60.2 111.175 179.881 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -151.0 169.41 21.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.141 -0.482 . . . . 64.24 110.845 -179.882 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 11.1 p90 -129.72 153.2 48.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.125 -0.489 . . . . 72.25 110.902 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.9 t -101.55 141.68 34.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.121 -0.49 . . . . 64.11 111.122 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.66 -17.78 1.47 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.173 -0.467 . . . . 72.14 110.894 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -65.09 -35.47 81.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.185 -0.462 . . . . 74.13 110.813 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.712 HD21 ' HA ' ' A' ' 179' ' ' THR . 1.8 mp -144.71 152.21 51.93 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 121.616 0.722 . . . . 72.52 110.907 -179.962 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . 0.568 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.3 Cg_endo -69.78 151.11 68.88 Favored 'Trans proline' 0 C--O 1.231 0.143 0 C-N-CA 122.762 2.308 . . . . 73.11 112.321 179.845 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 3.3 t-160 -52.68 -26.71 14.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.222 -0.444 . . . . 74.11 110.815 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.568 HG22 ' HB2' ' A' ' 101' ' ' PRO . 2.5 tp -76.64 -39.53 32.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.276 -0.42 . . . . 74.02 111.106 -179.939 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . 0.684 ' O ' HD22 ' A' ' 108' ' ' LEU . 3.3 m -69.24 -39.9 78.2 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.152 -0.476 . . . . 52.11 111.215 179.913 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.768 ' O ' HG13 ' A' ' 109' ' ' VAL . 70.6 t -72.62 -45.87 56.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.165 -0.47 . . . . 71.51 111.098 179.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.627 ' O ' HG22 ' A' ' 109' ' ' VAL . 59.7 t0 -58.56 -44.98 89.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.453 . . . . 63.44 110.844 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 14.4 ptm180 -70.2 -34.02 72.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.217 -0.447 . . . . 75.02 110.862 -179.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.684 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -61.21 -49.56 76.65 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.133 -0.485 . . . . 71.04 110.901 -179.93 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.768 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.4 m -55.99 -41.99 70.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.144 -0.48 . . . . 72.31 111.142 179.841 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.468 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 37.5 t -70.12 -34.16 72.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.19 -0.459 . . . . 72.14 110.869 -179.865 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.469 ' CG ' HD21 ' A' ' 189' ' ' LEU . 0.3 OUTLIER -62.29 -32.86 73.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.12 -0.491 . . . . 74.35 110.923 179.955 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -95.63 -40.98 9.14 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.232 -0.44 . . . . 74.32 111.06 179.828 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.813 ' CD1' HD12 ' A' ' 196' ' ' LEU . 0.5 OUTLIER -65.86 -33.15 75.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.278 -0.419 . . . . 72.0 110.856 -179.922 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 39.8 t30 -69.61 -39.14 77.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 72.34 110.844 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . 0.511 ' O ' HD11 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -62.58 -34.78 77.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.165 -0.471 . . . . 54.12 110.964 179.868 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 7.0 m95 -62.41 -51.85 65.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.152 -0.476 . . . . 75.23 110.946 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' GLY . . . . . 0.558 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -73.42 -24.06 75.87 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.726 -0.75 . . . . 73.32 112.478 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 24.9 mtmt -67.75 -13.93 62.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.726 0.298 . . . . 72.42 110.883 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.465 ' HG2' HG13 ' A' ' 231' ' ' ILE . 0.4 OUTLIER -107.51 13.93 26.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.278 -0.419 . . . . 75.24 110.824 -179.996 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 0.98 HD12 HD12 ' A' ' 122' ' ' LEU . 7.5 pt -144.61 155.96 56.57 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.642 0.734 . . . . 71.34 111.141 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.79 4.68 2.06 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.681 2.254 . . . . 72.21 112.344 179.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.98 HD12 HD12 ' A' ' 120' ' ' ILE . 4.9 mt -61.99 -156.36 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 73.22 110.88 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.479 ' CD2' HG23 ' A' ' 88' ' ' VAL . 4.9 t60 -163.12 138.06 6.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.227 -0.442 . . . . 74.12 110.868 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . 0.55 ' CD2' HD21 ' A' ' 113' ' ' LEU . 30.6 m-85 -123.35 141.77 51.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.165 -0.471 . . . . 75.54 110.864 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -121.55 141.54 50.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.141 -0.481 . . . . 75.14 110.838 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . 0.587 ' HE3' HG13 ' A' ' 128' ' ' VAL . 0.1 OUTLIER -80.78 146.48 30.95 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.18 -0.464 . . . . 72.22 110.913 179.94 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . 1.014 HG11 ' HB2' ' A' ' 132' ' ' ALA . 29.6 m -103.12 126.26 57.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.243 -0.435 . . . . 50.13 111.13 179.868 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.587 HG13 ' HE3' ' A' ' 126' ' ' LYS . 0.0 OUTLIER -141.55 -16.8 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.193 -0.458 . . . . 74.43 111.111 179.925 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' TRP . . . . . 0.531 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -147.21 109.1 4.41 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.199 -0.455 . . . . 71.25 110.949 179.955 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.69 -161.46 13.57 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.734 -0.746 . . . . 62.11 112.461 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.85 156.65 17.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.752 0.311 . . . . 63.25 111.176 -179.883 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . 1.014 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -111.22 164.62 12.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.213 -0.449 . . . . 51.34 111.089 179.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.53 -57.75 5.32 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.235 -0.439 . . . . 75.41 110.878 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 20.8 mt -82.57 132.86 30.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.222 -0.444 . . . . 70.51 111.138 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . 0.657 ' SD ' HG22 ' A' ' 94' ' ' VAL . 27.7 mmt -109.31 115.65 30.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.161 -0.472 . . . . 72.43 110.893 179.879 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -106.07 90.51 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.237 -0.438 . . . . 70.04 111.086 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . 0.468 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -129.84 167.96 21.43 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.735 -0.745 . . . . 63.34 112.45 179.905 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 138' ' ' PHE . . . . . 0.461 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 2.0 m-85 -105.39 149.62 25.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.869 0.366 . . . . 74.01 110.898 -179.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.614 ' HB1' ' CB ' ' A' ' 143' ' ' HIS . . . 175.84 167.23 0.39 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.129 -0.487 . . . . 71.21 111.104 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 72.8 mtt180 -104.14 173.78 6.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.217 -0.447 . . . . 62.21 110.853 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -56.59 -15.79 13.53 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.736 -0.745 . . . . 74.24 112.532 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -99.86 14.57 29.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.722 0.296 . . . . 75.03 111.023 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 143' ' ' HIS . . . . . 0.614 ' CB ' ' HB1' ' A' ' 139' ' ' ALA . 12.0 p80 -68.21 -33.45 74.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.246 -0.434 . . . . 71.11 110.875 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 147.13 47.01 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.808 -0.711 . . . . 45.51 112.475 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -158.49 149.86 20.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.829 0.347 . . . . 72.14 110.859 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 146' ' ' SER . . . . . 0.489 ' O ' ' CB ' ' A' ' 147' ' ' TYR . 37.6 m -63.66 98.39 0.18 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.166 -0.47 . . . . 51.25 110.847 -179.738 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 147' ' ' TYR . . . . . 0.489 ' CB ' ' O ' ' A' ' 146' ' ' SER . 0.2 OUTLIER 161.81 119.93 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.622 0.725 . . . . 73.4 110.939 -179.853 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.81 143.83 51.82 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.677 2.251 . . . . 74.53 112.324 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 149' ' ' PHE . . . . . 0.529 ' O ' ' CG ' ' A' ' 150' ' ' ASP . 0.2 OUTLIER -54.03 -22.73 11.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.133 -0.485 . . . . 63.52 110.845 -179.955 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . 0.529 ' CG ' ' O ' ' A' ' 149' ' ' PHE . 2.8 p30 50.12 18.55 0.4 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.227 -0.442 . . . . 63.11 110.818 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 41.17 -159.73 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.703 -0.761 . . . . 71.41 112.495 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 144.51 54.54 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.697 2.265 . . . . 75.11 112.382 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . 0.444 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 105.8 -134.33 12.05 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.699 -0.762 . . . . 70.32 112.535 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 154' ' ' ASN . . . . . 0.444 ' C ' ' O ' ' A' ' 153' ' ' GLY . 4.3 p30 -34.27 133.67 0.22 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.885 0.374 . . . . 73.25 110.888 -179.952 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 155' ' ' THR . . . . . 0.595 HG23 ' HA2' ' A' ' 68' ' ' GLY . 1.3 m 80.25 105.35 0.07 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.186 -0.461 . . . . 44.41 111.147 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 156' ' ' LEU . . . . . 0.972 HD21 HG21 ' A' ' 186' ' ' ILE . 0.6 OUTLIER -91.7 -55.53 3.44 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.236 -0.438 . . . . 75.02 110.965 179.895 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . 0.585 ' HB1' ' O ' ' A' ' 171' ' ' HIS . . . -158.45 148.4 19.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.186 -0.461 . . . . 71.42 111.161 179.771 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 158' ' ' HIS . . . . . 0.472 ' HB2' HG23 ' A' ' 69' ' ' VAL . 24.2 p-80 -111.24 116.33 30.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.243 -0.435 . . . . 72.02 110.845 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . 0.631 ' O ' HG21 ' A' ' 69' ' ' VAL . . . -110.86 151.46 27.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.228 -0.442 . . . . 74.42 111.114 179.904 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -118.73 161.17 20.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.216 -0.447 . . . . 75.31 110.845 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 161' ' ' ALA . . . . . 0.728 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -93.12 164.75 20.37 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.598 0.714 . . . . 61.04 111.061 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 162' ' ' PRO . . . . . 0.728 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.6 Cg_endo -69.86 84.43 0.67 Allowed 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.671 2.247 . . . . 74.44 112.323 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -115.21 117.1 3.9 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.718 -0.753 . . . . 61.41 112.507 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 2.5 m 72.68 -69.47 0.19 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.852 0.358 . . . . 73.1 111.162 -179.797 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . 179.08 -61.56 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.729 -0.748 . . . . 74.03 112.439 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 166' ' ' LEU . . . . . 0.804 HD22 ' C ' ' A' ' 166' ' ' LEU . 0.0 OUTLIER -53.91 -21.5 7.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.813 0.34 . . . . 65.12 110.898 -179.9 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . 0.717 ' N ' HD22 ' A' ' 166' ' ' LEU . . . -80.45 -171.5 43.68 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.736 -0.745 . . . . 43.43 112.473 179.908 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 72.88 21.11 80.01 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.723 -0.751 . . . . 74.31 112.523 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 76.8 m-20 -93.69 162.3 13.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.847 0.356 . . . . 63.41 110.889 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -113.34 131.35 55.99 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.145 -0.48 . . . . 74.21 111.064 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 171' ' ' HIS . . . . . 0.585 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 25.3 m170 -124.88 137.16 54.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.245 -0.434 . . . . 72.53 110.857 179.962 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 35.7 m-85 -118.73 139.27 51.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.179 -0.464 . . . . 71.44 110.91 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 55.3 t0 -72.24 100.99 2.72 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.16 -0.473 . . . . 74.11 110.857 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 174' ' ' GLU . . . . . 0.415 ' HG2' ' CD1' ' A' ' 138' ' ' PHE . 0.6 OUTLIER -57.86 -16.08 10.58 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.217 -0.447 . . . . 72.25 110.919 -179.879 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -79.32 -16.25 56.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.119 -0.492 . . . . 73.32 110.938 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 36.4 mm-40 -83.24 -179.51 7.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.18 -0.463 . . . . 63.2 110.878 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 1.5 mtt85 -116.26 113.71 23.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.116 -0.493 . . . . 63.14 110.829 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 5.8 m95 -116.64 147.91 41.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.271 -0.422 . . . . 72.31 110.905 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 179' ' ' THR . . . . . 0.712 ' HA ' HD21 ' A' ' 100' ' ' LEU . 9.2 t -178.73 163.56 1.46 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.246 -0.433 . . . . 74.13 111.194 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -121.7 -71.27 0.74 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.201 -0.454 . . . . 45.33 110.864 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -61.0 -14.9 40.67 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.787 -0.72 . . . . 62.41 112.451 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 182' ' ' SER . . . . . 0.611 ' HB3' HG21 ' A' ' 179' ' ' THR . 0.2 OUTLIER -94.89 -24.33 17.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.926 0.394 . . . . 64.5 110.886 -179.717 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 183' ' ' SER . . . . . 0.451 ' C ' ' O ' ' A' ' 182' ' ' SER . 30.8 m 32.78 59.21 0.42 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.144 -0.48 . . . . 64.12 110.821 -179.869 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 1.3 tt -116.73 -33.58 4.77 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.146 -0.479 . . . . 74.2 110.897 179.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -117.94 -137.95 5.88 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.697 -0.763 . . . . 73.01 112.531 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 186' ' ' ILE . . . . . 0.972 HG21 HD21 ' A' ' 156' ' ' LEU . 9.4 mm -79.48 97.58 2.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.859 0.361 . . . . 73.22 111.128 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -48.41 119.92 3.33 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.139 -0.482 . . . . 71.31 110.871 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 188' ' ' PHE . . . . . 0.727 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.5 t80 -54.16 -36.0 62.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.179 -0.464 . . . . 75.45 110.837 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . 0.469 HD21 ' CG ' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -67.55 -47.85 68.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.144 -0.48 . . . . 52.02 110.901 -179.928 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 54.6 t80 -69.5 -39.11 77.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.195 -0.457 . . . . 74.22 110.909 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 191' ' ' ALA . . . . . 0.666 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -72.52 -34.59 67.71 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.129 -0.487 . . . . 50.03 111.165 179.791 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 192' ' ' ALA . . . . . 0.652 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -56.17 -44.73 79.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.207 -0.451 . . . . 52.11 111.118 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 193' ' ' THR . . . . . 0.578 HG21 HG21 ' A' ' 211' ' ' VAL . 0.3 OUTLIER -57.97 -41.32 82.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.193 -0.458 . . . . 72.43 111.184 -179.958 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -73.02 -46.3 52.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.272 -0.422 . . . . 71.44 110.867 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -68.24 -47.71 67.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.187 -0.461 . . . . 71.01 111.141 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 196' ' ' LEU . . . . . 0.813 HD12 ' CD1' ' A' ' 113' ' ' LEU . 4.4 mm? -64.67 -41.86 95.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.152 -0.476 . . . . 74.51 110.95 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -55.07 -30.93 55.57 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.749 -0.738 . . . . 52.23 112.532 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 198' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 -66.97 -33.48 75.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.684 0.278 . . . . 75.21 110.839 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 5.5 t -68.5 -20.4 64.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.231 -0.44 . . . . 71.13 110.9 -179.778 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 200' ' ' LEU . . . . . 0.41 ' HA ' ' CD1' ' A' ' 84' ' ' TRP . 0.3 OUTLIER -90.57 -2.6 57.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.065 -0.516 . . . . 64.13 110.866 -179.968 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 84.27 8.75 83.12 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.796 -0.716 . . . . 50.41 112.519 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 202' ' ' MET . . . . . 0.455 ' HE1' ' HB ' ' A' ' 234' ' ' ILE . 32.9 tpp -67.54 142.13 56.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.829 0.347 . . . . 63.21 110.877 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -104.7 159.16 16.06 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.715 -0.755 . . . . 64.44 112.487 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 13.7 m-70 -58.58 159.35 6.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.795 0.331 . . . . 74.32 110.855 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 205' ' ' SER . . . . . 0.503 ' OG ' ' HB1' ' A' ' 210' ' ' ALA . 0.0 OUTLIER -121.09 150.05 41.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.251 -0.432 . . . . 53.34 110.817 -179.736 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 4.3 p -87.99 -4.2 58.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.157 -0.474 . . . . 72.22 110.846 -179.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.18 138.12 84.48 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.57 0.7 . . . . 65.11 110.879 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.84 -8.13 22.83 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.663 2.242 . . . . 74.53 112.319 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -126.56 29.36 5.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.221 -0.445 . . . . 63.52 110.941 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 210' ' ' ALA . . . . . 0.503 ' HB1' ' OG ' ' A' ' 205' ' ' SER . . . -87.36 145.53 26.28 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.156 -0.474 . . . . 62.23 111.109 179.908 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 211' ' ' VAL . . . . . 0.578 HG21 HG21 ' A' ' 193' ' ' THR . 0.4 OUTLIER -68.1 -28.34 40.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.215 -0.448 . . . . 62.04 111.147 179.954 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 21.0 mmm -96.97 9.89 40.72 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.169 -0.468 . . . . 75.22 110.893 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 213' ' ' TYR . . . . . 0.409 ' HA ' ' HD2' ' A' ' 214' ' ' PRO . 2.0 t80 -55.6 114.99 8.28 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-O 121.718 0.77 . . . . 73.43 110.949 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 214' ' ' PRO . . . . . 0.409 ' HD2' ' HA ' ' A' ' 213' ' ' TYR . 53.2 Cg_endo -69.72 -18.45 37.17 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.675 2.25 . . . . 63.01 112.316 -179.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -84.34 51.54 2.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.225 -0.443 . . . . 74.24 111.128 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 6.8 t80 . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 116.279 -0.419 . . . . 74.14 110.894 -179.919 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 224' ' ' PHE . . . . . 0.443 ' HE1' HG21 ' A' ' 193' ' ' THR . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.905 0.383 . . . . 65.01 110.858 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -143.54 161.63 37.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.168 -0.469 . . . . 64.24 110.828 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 226' ' ' LEU . . . . . 0.661 HD22 HD11 ' A' ' 231' ' ' ILE . 37.5 mt -66.52 148.26 52.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.193 -0.458 . . . . 53.44 110.895 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 227' ' ' SER . . . . . 0.433 ' HB3' ' HA ' ' A' ' 210' ' ' ALA . 0.0 OUTLIER -87.89 152.84 21.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.189 -0.459 . . . . 74.21 110.837 -179.94 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -65.58 -68.65 0.35 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.12 -0.491 . . . . 74.54 110.9 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 229' ' ' ASP . . . . . 0.415 ' O ' ' HG2' ' A' ' 232' ' ' LYS . 0.4 OUTLIER -56.3 -24.7 45.1 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.223 -0.444 . . . . 72.22 110.897 179.965 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 40.4 t0 -68.38 -49.84 57.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 74.23 110.868 180.0 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 231' ' ' ILE . . . . . 0.661 HD11 HD22 ' A' ' 226' ' ' LEU . 2.8 mm -69.82 -43.15 80.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.225 -0.443 . . . . 73.41 111.085 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 232' ' ' LYS . . . . . 0.415 ' HG2' ' O ' ' A' ' 229' ' ' ASP . 7.9 ptmt -57.58 -31.87 66.59 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.191 -0.459 . . . . 65.42 110.916 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -68.83 -45.54 64.09 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.714 -0.755 . . . . 63.43 112.486 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 234' ' ' ILE . . . . . 0.455 ' HB ' ' HE1' ' A' ' 202' ' ' MET . 5.5 tt -72.86 -34.36 46.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.724 0.297 . . . . 71.54 111.223 179.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -66.31 -26.89 67.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.116 -0.493 . . . . 70.33 110.956 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 236' ' ' LYS . . . . . 0.452 ' HE3' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.67 -22.48 58.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.169 -0.468 . . . . 51.21 110.927 179.925 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 237' ' ' LEU . . . . . 0.829 HD23 ' HD2' ' A' ' 83' ' ' LYS . 1.1 tp -97.24 -16.13 20.51 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.166 -0.47 . . . . 75.41 110.908 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 238' ' ' TYR . . . . . 0.649 ' CZ ' HD11 ' A' ' 122' ' ' LEU . 11.6 m-85 -105.39 -35.19 7.59 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.189 -0.459 . . . . 51.24 110.946 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.309 0 C-N-CA 120.726 -0.75 . . . . 32.22 112.46 179.986 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 37.5 t-105 . . . . . 0 C--O 1.23 0.051 0 CA-C-O 120.684 0.278 . . . . 71.22 110.923 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -72.98 -35.37 66.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.238 -0.437 . . . . 72.51 110.906 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -63.41 -36.78 84.88 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.156 -0.475 . . . . 61.24 110.881 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.618 ' HB1' ' CE ' ' A' ' 62' ' ' MET . . . -62.44 -34.87 77.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.223 -0.444 . . . . 54.34 111.14 179.93 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.651 HE22 HD22 ' A' ' 35' ' ' LEU . 0.7 OUTLIER -66.07 -43.0 88.64 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.155 -0.475 . . . . 73.12 110.95 -179.958 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -76.81 -34.1 57.94 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.152 -0.477 . . . . 72.4 110.884 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -70.7 -35.91 73.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.15 -0.477 . . . . 75.11 110.911 -179.864 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.631 HD13 ' O ' ' A' ' 19' ' ' LEU . 3.2 tm? -68.31 -26.03 65.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.159 -0.473 . . . . 72.51 110.873 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.56 ' HA ' ' CE1' ' A' ' 23' ' ' TYR . 7.0 ptmt -68.87 -37.11 78.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.178 -0.464 . . . . 74.41 110.86 179.899 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.455 ' N ' ' HG2' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -79.4 -21.83 45.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.255 -0.43 . . . . 74.05 110.88 -179.996 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -55.41 -30.39 60.34 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.235 -0.439 . . . . 74.31 110.827 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.56 ' CE1' ' HA ' ' A' ' 20' ' ' LYS . 44.9 p90 . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.104 -0.498 . . . . 72.55 110.923 -179.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.651 HD22 HE22 ' A' ' 16' ' ' GLN . 35.1 tp . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.746 0.308 . . . . 72.52 110.891 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -56.76 -50.7 71.49 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.146 -0.479 . . . . 73.13 110.933 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.55 -36.59 83.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.202 -0.454 . . . . 63.32 111.089 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.403 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.0 OUTLIER -69.43 -48.62 60.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.254 -0.43 . . . . 72.32 110.935 179.961 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.746 ' CD1' HD23 ' A' ' 54' ' ' LEU . 10.2 mt -54.42 -38.59 66.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.159 -0.473 . . . . 72.11 110.937 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.0 ttmm -58.75 -46.1 88.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.166 -0.47 . . . . 62.43 110.828 179.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.403 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 1.6 pt-20 -70.11 -33.35 71.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.221 -0.445 . . . . 75.11 110.842 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.707 ' CE ' HD11 ' A' ' 61' ' ' ILE . 4.2 ttt -68.27 -46.43 70.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.222 -0.445 . . . . 63.43 110.861 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.513 ' CB ' HG22 ' A' ' 51' ' ' THR . 1.7 mt-30 -63.96 -41.77 97.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.254 -0.43 . . . . 74.45 110.911 -179.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.445 ' HE3' HG21 ' A' ' 51' ' ' THR . 8.4 mmtt -66.69 -25.44 66.54 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.147 -0.478 . . . . 71.43 110.837 -179.93 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 38.2 t80 -69.66 -37.03 76.55 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.29 -0.414 . . . . 73.32 110.88 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.597 ' CZ ' HD12 ' A' ' 61' ' ' ILE . 11.8 m-85 -81.27 -31.47 33.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.174 -0.466 . . . . 70.43 110.901 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 104.55 -10.1 49.34 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.776 -0.726 . . . . 64.34 112.469 180.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.546 HD23 ' HB3' ' A' ' 46' ' ' PHE . 0.5 OUTLIER -61.62 144.13 93.02 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.612 0.72 . . . . 64.11 110.922 -179.923 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.501 ' O ' HG23 ' A' ' 51' ' ' THR . 53.4 Cg_endo -69.72 -54.66 0.21 Allowed 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.66 2.24 . . . . 74.5 112.307 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.545 HD12 ' CG2' ' A' ' 58' ' ' VAL . 0.8 OUTLIER -51.04 108.26 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.248 -0.433 . . . . 71.22 111.132 179.988 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.513 HG22 ' CB ' ' A' ' 43' ' ' GLN . 40.3 p -123.38 157.41 33.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.214 -0.448 . . . . 73.25 111.129 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 84.06 -10.85 59.49 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.742 -0.742 . . . . 64.24 112.491 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 1.2 mtt -135.16 156.81 48.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.895 0.379 . . . . 75.23 110.874 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.746 HD23 ' CD1' ' A' ' 39' ' ' LEU . 1.9 pp -156.99 129.15 7.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.2 -0.455 . . . . 73.4 110.917 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 173.87 -29.33 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.216 -0.447 . . . . 44.35 110.936 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 26.1 t -94.16 -89.15 0.23 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.116 -0.493 . . . . 75.25 110.859 -179.871 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.599 ' O ' HG23 ' A' ' 61' ' ' ILE . 7.6 tpt180 -84.76 -35.99 22.05 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.118 -0.492 . . . . 61.22 110.919 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.545 ' CG2' HD12 ' A' ' 50' ' ' ILE . 21.8 t -60.26 -41.73 88.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.132 -0.485 . . . . 70.12 111.132 179.941 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.402 HD13 ' HB2' ' A' ' 62' ' ' MET . 0.2 OUTLIER -74.67 -31.01 25.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.192 -0.458 . . . . 74.43 111.133 179.939 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -59.97 -43.79 94.88 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.128 -0.487 . . . . 73.45 110.921 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.707 HD11 ' CE ' ' A' ' 42' ' ' MET . 0.7 OUTLIER -65.92 -29.78 47.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.148 -0.478 . . . . 74.52 111.167 179.893 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . 0.618 ' CE ' ' HB1' ' A' ' 15' ' ' ALA . 3.9 mmm -70.39 -33.75 71.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.133 -0.485 . . . . 74.01 110.889 179.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -88.08 -25.88 22.82 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.202 -0.454 . . . . 42.22 110.898 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.1 mtmp? -85.04 151.93 58.03 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.553 0.692 . . . . 65.34 110.927 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . 0.545 ' HB2' HD22 ' A' ' 156' ' ' LEU . 53.8 Cg_endo -69.77 143.68 51.57 Favored 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.695 2.264 . . . . 72.11 112.381 179.879 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 25.8 ttp180 -141.36 -85.52 0.18 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.273 -0.421 . . . . 71.51 110.855 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 16.2 p -145.67 143.75 29.99 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.233 -0.439 . . . . 55.3 110.894 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.636 ' HA2' HG23 ' A' ' 155' ' ' THR . . . -89.08 11.87 68.01 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.683 -0.77 . . . . 64.23 112.466 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.493 HG12 ' HD2' ' A' ' 70' ' ' PRO . 0.1 OUTLIER -116.93 141.4 28.25 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.577 0.703 . . . . 74.23 111.139 -179.987 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . 0.493 ' HD2' HG12 ' A' ' 69' ' ' VAL . 53.6 Cg_endo -69.74 178.12 4.87 Favored 'Trans proline' 0 N--CA 1.465 -0.148 0 C-N-CA 122.719 2.28 . . . . 63.44 112.316 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -128.68 42.63 3.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.204 -0.453 . . . . 74.45 110.798 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.226 -0.443 . . . . 53.43 111.105 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo . . . . . 0 C--O 1.231 0.133 0 CA-C-O 120.841 0.267 . . . . 71.11 112.311 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.708 ' HD3' HD22 ' A' ' 237' ' ' LEU . 5.1 mtpt -106.78 155.24 19.91 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.231 -0.441 . . . . 64.45 110.934 179.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . 0.652 ' CE3' HG21 ' A' ' 89' ' ' VAL . 38.4 m0 -50.11 112.33 0.66 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.21 -0.45 . . . . 73.31 110.938 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -115.37 -8.1 12.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.251 -0.432 . . . . 65.3 111.105 -179.894 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -59.57 176.13 0.29 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.23 -0.441 . . . . 70.34 110.84 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.34 -30.78 25.21 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.075 -0.512 . . . . 71.12 110.832 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.411 HG23 ' CD2' ' A' ' 123' ' ' HIS . 0.3 OUTLIER -156.79 144.48 10.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.269 -0.423 . . . . 74.14 111.113 179.865 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.652 HG21 ' CE3' ' A' ' 84' ' ' TRP . 21.7 t -129.33 134.53 63.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.14 -0.482 . . . . 72.25 111.116 179.926 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.461 ' C ' ' HB1' ' A' ' 132' ' ' ALA . 22.0 p -115.66 151.84 34.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.213 -0.449 . . . . 71.01 111.137 -179.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 4.6 p90 -132.2 146.01 51.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.227 -0.442 . . . . 70.51 110.937 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 9.4 ttt180 -146.61 136.5 23.33 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.088 -0.505 . . . . 71.25 110.828 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.419 HD11 ' HA ' ' A' ' 106' ' ' ASP . 10.4 mm -75.87 134.18 29.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.154 -0.475 . . . . 72.4 111.092 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.45 ' HB ' ' HA3' ' A' ' 137' ' ' GLY . 15.1 t -92.29 -40.37 12.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.174 -0.466 . . . . 60.2 111.196 179.776 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -150.41 169.45 21.41 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.16 -0.473 . . . . 64.24 110.848 -179.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 16.7 p90 -132.24 155.25 48.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.201 -0.454 . . . . 72.25 110.926 -179.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 2.9 t -99.72 141.89 31.93 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.076 -0.511 . . . . 64.11 111.126 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.4 -18.02 1.45 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.195 -0.457 . . . . 72.14 110.876 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -65.02 -35.95 82.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.183 -0.462 . . . . 74.13 110.839 -180.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.493 HD23 HG21 ' A' ' 104' ' ' THR . 1.8 mp -144.24 152.45 54.2 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.554 0.693 . . . . 72.52 110.959 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . 0.582 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.2 Cg_endo -69.79 151.07 68.77 Favored 'Trans proline' 0 C--O 1.232 0.216 0 C-N-CA 122.717 2.278 . . . . 73.11 112.32 179.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 -51.07 -26.66 6.67 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.173 -0.467 . . . . 74.11 110.901 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.582 HG22 ' HB2' ' A' ' 101' ' ' PRO . 10.5 tp -76.74 -38.45 30.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.181 -0.463 . . . . 74.02 111.101 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . 0.642 ' O ' HD22 ' A' ' 108' ' ' LEU . 3.2 m -68.86 -39.47 79.85 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.197 -0.456 . . . . 52.11 111.198 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.756 ' O ' HG13 ' A' ' 109' ' ' VAL . 69.9 t -73.0 -45.29 55.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.21 -0.45 . . . . 71.51 111.101 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.662 ' O ' HG22 ' A' ' 109' ' ' VAL . 43.3 t0 -60.39 -44.96 95.16 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.213 -0.449 . . . . 63.44 110.903 179.873 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 11.5 ptm180 -70.15 -33.5 71.88 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.183 -0.462 . . . . 75.02 110.925 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.642 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -60.68 -48.89 79.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.193 -0.458 . . . . 71.04 110.922 -179.984 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.756 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.5 m -55.44 -41.68 63.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.156 -0.475 . . . . 72.31 111.197 179.845 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.465 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 47.7 t -70.11 -33.57 72.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.173 -0.467 . . . . 72.14 110.875 -179.902 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.465 ' HB3' HD21 ' A' ' 189' ' ' LEU . 0.4 OUTLIER -61.96 -33.01 73.5 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.091 -0.504 . . . . 74.35 110.892 179.929 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.29 -40.32 9.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.26 -0.427 . . . . 74.32 111.049 179.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 1.016 HD13 HD12 ' A' ' 196' ' ' LEU . 6.4 tp -65.31 -32.54 74.25 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.29 -0.413 . . . . 72.0 110.884 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -65.37 -38.4 89.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.213 -0.449 . . . . 72.34 110.87 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . 0.641 ' O ' HD11 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -62.24 -34.48 76.58 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.232 -0.44 . . . . 54.12 110.883 179.856 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 7.1 m95 -67.04 -52.41 42.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.223 -0.444 . . . . 75.23 110.863 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -59.65 -37.87 92.93 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.718 -0.753 . . . . 73.32 112.522 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.1 mmpt? -61.34 -17.07 52.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.729 0.3 . . . . 72.42 110.872 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.819 ' HG2' HD13 ' A' ' 226' ' ' LEU . 0.5 OUTLIER -98.99 12.85 34.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.242 -0.436 . . . . 75.24 110.902 179.992 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 1.9 pt -148.28 145.76 21.35 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.711 0.767 . . . . 71.34 111.059 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.84 6.32 1.38 Allowed 'Trans proline' 0 C--N 1.343 0.249 0 C-N-CA 122.678 2.252 . . . . 72.21 112.341 179.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.433 ' HA ' HD23 ' A' ' 122' ' ' LEU . 4.1 mt -62.77 -156.95 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.203 -0.453 . . . . 73.22 110.962 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.411 ' CD2' HG23 ' A' ' 88' ' ' VAL . 4.3 t60 -154.6 123.15 6.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.284 -0.416 . . . . 74.12 110.882 179.882 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 9.2 m-30 -108.23 133.14 52.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.224 -0.444 . . . . 75.54 110.868 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.425 ' O ' HG22 ' A' ' 90' ' ' THR . 0.0 OUTLIER -119.29 141.66 48.78 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.165 -0.47 . . . . 75.14 110.921 -179.915 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.82 160.27 24.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.197 -0.456 . . . . 72.22 110.852 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . 0.731 HG11 ' HB2' ' A' ' 132' ' ' ALA . 18.2 m -103.1 126.61 57.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.185 -0.462 . . . . 50.13 111.102 179.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.583 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -146.96 -13.35 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.157 -0.474 . . . . 74.43 111.138 179.896 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' TRP . . . . . 0.583 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -153.65 109.05 3.2 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.173 -0.467 . . . . 71.25 110.89 179.919 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 102.45 -165.09 16.66 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.804 -0.712 . . . . 62.11 112.541 179.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.99 155.67 18.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.824 0.345 . . . . 63.25 111.093 -179.835 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . 0.731 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -112.37 165.7 11.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.213 -0.449 . . . . 51.34 111.06 179.811 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -76.34 -41.67 47.53 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.19 -0.459 . . . . 75.41 110.885 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . 0.65 HG23 ' O ' ' A' ' 168' ' ' GLY . 3.9 mm -94.76 107.83 19.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.185 -0.461 . . . . 70.51 111.146 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . 0.433 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 9.3 mmm -98.59 122.5 41.87 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.152 -0.476 . . . . 72.43 110.929 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -106.28 95.23 3.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.262 -0.426 . . . . 70.04 111.162 179.99 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . 0.45 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -132.6 165.93 23.63 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.755 -0.736 . . . . 63.34 112.495 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 138' ' ' PHE . . . . . 0.539 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 2.8 m-85 -107.11 147.07 30.49 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.838 0.351 . . . . 74.01 110.872 -179.844 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.539 ' HB2' ' O ' ' A' ' 138' ' ' PHE . . . 170.96 166.35 0.08 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.166 -0.47 . . . . 71.21 111.131 179.894 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 34.8 mtp180 -105.05 173.57 6.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.183 -0.462 . . . . 62.21 110.87 -179.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -53.51 -22.02 15.36 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.742 -0.742 . . . . 74.24 112.455 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -67.48 -10.9 55.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.827 0.346 . . . . 75.03 111.163 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 2.5 p80 -68.81 -11.91 60.94 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 71.11 110.865 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 118.63 39.57 0.71 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.736 -0.745 . . . . 45.51 112.454 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -123.3 141.1 52.33 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.748 0.309 . . . . 72.14 110.872 -179.952 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 3.0 m -64.23 156.03 30.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.219 -0.446 . . . . 51.25 110.902 -179.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 64.93 133.24 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.691 0.758 . . . . 73.4 110.881 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 134.67 28.52 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.712 2.275 . . . . 74.53 112.358 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -66.99 -29.69 69.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.26 -0.427 . . . . 63.52 110.865 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 75.21 -2.8 2.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.118 -0.492 . . . . 63.11 110.94 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 57.0 -117.3 9.31 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.718 -0.753 . . . . 71.41 112.475 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 138.9 38.82 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.649 2.233 . . . . 75.11 112.34 -179.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 103.16 -147.9 17.02 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.779 -0.724 . . . . 70.32 112.501 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -39.97 149.04 0.07 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.887 0.375 . . . . 73.25 110.9 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 155' ' ' THR . . . . . 0.636 HG23 ' HA2' ' A' ' 68' ' ' GLY . 0.9 OUTLIER 75.99 110.55 0.07 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.158 -0.474 . . . . 44.41 111.131 -179.957 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 156' ' ' LEU . . . . . 1.002 HD21 HG21 ' A' ' 186' ' ' ILE . 0.6 OUTLIER -96.1 -53.35 3.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.133 -0.485 . . . . 75.02 110.882 179.995 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . 0.573 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -161.63 147.71 13.91 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.209 -0.451 . . . . 71.42 111.069 179.8 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 24.5 p-80 -109.63 125.72 52.88 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 72.02 110.86 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -109.41 171.25 7.55 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.193 -0.458 . . . . 74.42 111.105 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -125.9 153.28 44.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 75.31 110.856 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 161' ' ' ALA . . . . . 0.757 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -86.27 165.46 33.54 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.605 0.717 . . . . 61.04 111.061 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 162' ' ' PRO . . . . . 0.757 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.7 Cg_endo -69.73 75.52 1.19 Allowed 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.696 2.264 . . . . 74.44 112.36 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -136.29 102.61 0.41 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.708 -0.758 . . . . 61.41 112.481 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 164' ' ' THR . . . . . 0.442 HG22 ' H ' ' A' ' 165' ' ' GLY . 0.2 OUTLIER 68.28 174.5 0.28 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.775 0.321 . . . . 73.1 111.135 -179.908 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 165' ' ' GLY . . . . . 0.442 ' H ' HG22 ' A' ' 164' ' ' THR . . . -52.07 -50.65 44.55 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.739 -0.743 . . . . 74.03 112.502 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 166' ' ' LEU . . . . . 0.675 HD13 ' O ' ' A' ' 166' ' ' LEU . 3.4 tm? -58.71 -31.19 68.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.845 0.355 . . . . 65.12 110.915 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -72.97 151.22 45.42 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.669 -0.777 . . . . 43.43 112.481 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 168' ' ' GLY . . . . . 0.65 ' O ' HG23 ' A' ' 134' ' ' ILE . . . 86.2 15.99 63.57 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.782 -0.723 . . . . 74.31 112.472 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -87.37 147.88 25.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.791 0.329 . . . . 63.41 110.898 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.58 130.38 56.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 74.21 111.088 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 171' ' ' HIS . . . . . 0.55 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 50.0 m170 -131.43 139.04 49.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.244 -0.435 . . . . 72.53 110.807 -179.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 48.5 m-85 -122.34 140.07 53.08 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.184 -0.462 . . . . 71.44 110.858 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 63.5 t0 -69.14 98.25 0.99 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.196 -0.456 . . . . 74.11 110.853 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.94 -16.46 12.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.157 -0.474 . . . . 72.25 110.857 -179.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -79.25 -16.25 56.76 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.112 -0.494 . . . . 73.32 110.85 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 27.8 mm-40 -81.99 -176.78 6.31 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.166 -0.47 . . . . 63.2 110.918 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 32.3 mtm180 -116.49 114.4 24.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 63.14 110.917 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 5.7 m95 -117.24 150.33 38.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.244 -0.434 . . . . 72.31 110.855 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 179' ' ' THR . . . . . 0.581 HG21 ' HB3' ' A' ' 182' ' ' SER . 12.2 t -179.82 163.87 1.16 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.231 -0.441 . . . . 74.13 111.14 -179.934 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -122.27 -67.53 0.95 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.253 -0.43 . . . . 45.33 110.839 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -67.49 -10.73 58.29 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.748 -0.739 . . . . 62.41 112.495 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 182' ' ' SER . . . . . 0.581 ' HB3' HG21 ' A' ' 179' ' ' THR . 0.2 OUTLIER -98.28 -24.51 15.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.856 0.36 . . . . 64.5 110.888 -179.768 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 183' ' ' SER . . . . . 0.458 ' C ' ' O ' ' A' ' 182' ' ' SER . 53.0 p 32.69 61.58 0.36 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.085 -0.507 . . . . 64.12 110.877 -179.83 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 6.0 tt -116.89 -33.7 4.68 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 74.2 110.894 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -121.33 -136.45 5.04 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.734 -0.746 . . . . 73.01 112.503 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 186' ' ' ILE . . . . . 1.002 HG21 HD21 ' A' ' 156' ' ' LEU . 7.7 mm -79.36 97.41 2.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.871 0.367 . . . . 73.22 111.165 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -50.94 121.32 5.84 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.154 -0.476 . . . . 71.31 110.879 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 188' ' ' PHE . . . . . 0.753 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.5 t80 -54.2 -35.68 62.64 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.224 -0.444 . . . . 75.45 110.913 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . 0.52 HD12 ' HE2' ' A' ' 224' ' ' PHE . 0.2 OUTLIER -67.37 -48.17 68.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.094 -0.503 . . . . 52.02 110.865 -179.998 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 9.7 t80 -69.88 -37.45 76.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.152 -0.476 . . . . 74.22 110.935 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 191' ' ' ALA . . . . . 0.662 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -72.55 -35.9 68.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.099 -0.501 . . . . 50.03 111.092 179.895 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 192' ' ' ALA . . . . . 0.66 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -57.13 -45.19 83.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.251 -0.431 . . . . 52.11 111.105 179.952 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.78 -41.03 85.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.189 -0.46 . . . . 72.43 111.162 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 13.9 t-160 -73.1 -44.97 59.66 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.215 -0.448 . . . . 71.44 110.872 179.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -69.48 -48.15 61.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.244 -0.435 . . . . 71.01 111.101 179.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 196' ' ' LEU . . . . . 1.016 HD12 HD13 ' A' ' 113' ' ' LEU . 4.4 mm? -64.06 -39.42 94.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.114 -0.493 . . . . 74.51 110.909 -179.908 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -63.31 -25.15 68.13 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.745 -0.741 . . . . 52.23 112.526 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 198' ' ' HIS . . . . . . . . . . . . . 5.5 m-70 -68.7 -43.6 75.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.834 0.35 . . . . 75.21 110.857 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . 0.46 ' O ' ' HD3' ' A' ' 162' ' ' PRO . 0.2 OUTLIER -58.83 -25.68 63.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.233 -0.439 . . . . 71.13 110.921 -179.788 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -85.05 1.13 49.11 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.104 -0.498 . . . . 64.13 110.891 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 85.19 -9.36 67.02 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.787 -0.72 . . . . 50.41 112.525 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 202' ' ' MET . . . . . 0.448 ' CE ' ' HB ' ' A' ' 234' ' ' ILE . 0.0 OUTLIER -54.2 134.52 44.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.808 0.337 . . . . 63.21 110.828 -179.964 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -101.05 172.69 23.66 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.719 -0.753 . . . . 64.44 112.465 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 204' ' ' HIS . . . . . 0.42 ' HA ' ' HB3' ' A' ' 212' ' ' MET . 20.7 m-70 -67.45 163.64 20.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.827 0.346 . . . . 74.32 110.864 -179.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -124.66 153.47 42.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.223 -0.444 . . . . 53.34 110.856 -179.781 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 3.1 p -87.64 -4.27 58.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.156 -0.475 . . . . 72.22 110.819 -179.775 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.19 135.88 84.62 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.58 0.705 . . . . 65.11 110.924 179.952 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -69.83 -6.15 17.95 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.594 2.196 . . . . 74.53 112.292 -179.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -130.05 29.96 4.87 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.227 -0.442 . . . . 63.52 110.9 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 210' ' ' ALA . . . . . 0.478 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.27 145.33 26.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.142 -0.481 . . . . 62.23 111.09 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 211' ' ' VAL . . . . . 0.448 HG12 ' OD2' ' A' ' 230' ' ' ASP . 0.4 OUTLIER -67.21 -27.67 39.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.153 -0.476 . . . . 62.04 111.199 179.933 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 212' ' ' MET . . . . . 0.42 ' HB3' ' HA ' ' A' ' 204' ' ' HIS . 1.3 ttm -97.11 8.61 44.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.13 -0.486 . . . . 75.22 110.861 179.918 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 213' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -55.78 116.55 12.44 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.697 0.761 . . . . 73.43 110.845 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.89 -18.41 36.43 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.711 2.274 . . . . 63.01 112.282 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.7 51.1 2.05 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.239 -0.437 . . . . 74.24 111.139 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 8.4 t80 . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.265 -0.425 . . . . 74.14 110.974 -179.93 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 224' ' ' PHE . . . . . 0.52 ' HE2' HD12 ' A' ' 189' ' ' LEU . 0.3 OUTLIER . . . . . 0 CA--C 1.527 0.073 0 CA-C-O 120.92 0.391 . . . . 65.01 110.862 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 3.0 mttp -144.51 168.99 18.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.093 -0.503 . . . . 64.24 110.866 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 226' ' ' LEU . . . . . 0.819 HD13 ' HG2' ' A' ' 119' ' ' GLU . 21.9 mt -60.08 148.82 34.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 53.44 110.845 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 227' ' ' SER . . . . . 0.505 ' O ' HG12 ' A' ' 231' ' ' ILE . 0.0 OUTLIER -86.93 150.78 23.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.147 -0.479 . . . . 74.21 110.853 -179.95 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -64.38 -64.21 0.94 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.113 -0.494 . . . . 74.54 110.859 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 229' ' ' ASP . . . . . 0.404 ' HA ' ' HG2' ' A' ' 232' ' ' LYS . 17.9 t70 -55.48 -26.92 45.21 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.174 -0.466 . . . . 72.22 110.864 -179.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 230' ' ' ASP . . . . . 0.448 ' OD2' HG12 ' A' ' 211' ' ' VAL . 61.7 t0 -69.73 -50.23 45.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.155 -0.475 . . . . 74.23 110.896 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 231' ' ' ILE . . . . . 0.675 HD11 HD22 ' A' ' 226' ' ' LEU . 3.9 mm -69.75 -40.59 79.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.183 -0.462 . . . . 73.41 111.154 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 232' ' ' LYS . . . . . 0.411 ' HG3' ' N ' ' A' ' 233' ' ' GLY . 0.0 OUTLIER -56.46 -31.93 64.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.222 -0.445 . . . . 65.42 110.918 179.835 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 233' ' ' GLY . . . . . 0.411 ' N ' ' HG3' ' A' ' 232' ' ' LYS . . . -64.82 -49.72 62.04 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.729 -0.748 . . . . 63.43 112.529 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 234' ' ' ILE . . . . . 0.448 ' HB ' ' CE ' ' A' ' 202' ' ' MET . 8.4 tt -72.99 -30.28 31.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 120.76 0.314 . . . . 71.54 111.104 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -61.46 -29.29 69.87 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.233 -0.439 . . . . 70.33 110.896 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 236' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.58 -25.46 59.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.267 -0.424 . . . . 51.21 110.887 -179.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 237' ' ' LEU . . . . . 0.708 HD22 ' HD3' ' A' ' 83' ' ' LYS . 9.7 tt -97.42 -26.22 14.93 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.259 -0.428 . . . . 75.41 110.899 179.89 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 238' ' ' TYR . . . . . 0.44 ' CD1' HG13 ' A' ' 234' ' ' ILE . 5.4 m-85 -92.44 -35.38 13.69 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.235 -0.439 . . . . 51.24 110.881 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.314 0 C-N-CA 120.735 -0.745 . . . . 32.22 112.482 179.958 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 6.5 t-105 . . . . . 0 C--O 1.232 0.15 0 CA-C-O 120.668 0.271 . . . . 71.22 110.847 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -63.96 -36.67 84.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.341 -0.39 . . . . 72.51 110.902 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -63.07 -36.89 85.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 61.24 110.897 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.646 ' HB1' ' HE3' ' A' ' 62' ' ' MET . . . -57.16 -37.36 71.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.166 -0.47 . . . . 54.34 111.099 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.695 ' NE2' HD12 ' A' ' 35' ' ' LEU . 0.7 OUTLIER -67.16 -43.0 83.38 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.2 -0.455 . . . . 73.12 110.917 -179.932 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -70.08 -31.41 68.99 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.162 -0.472 . . . . 72.4 110.882 180.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 14.8 m-85 -67.68 -50.5 57.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.188 -0.46 . . . . 75.11 110.948 -179.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.488 HD13 ' C ' ' A' ' 19' ' ' LEU . 2.8 tm? -67.82 -33.46 74.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.094 -0.503 . . . . 72.51 110.836 -179.94 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 4.9 tptt -57.15 -39.82 76.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.196 -0.456 . . . . 74.41 110.902 179.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.8 ptm180 -83.91 -25.29 30.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.242 -0.435 . . . . 74.05 110.917 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.427 ' HB2' ' HA ' ' A' ' 19' ' ' LEU . 0.4 OUTLIER -59.08 -20.17 50.93 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 74.31 110.865 -179.936 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 3.8 p90 . . . . . 0 C--N 1.328 -0.357 0 CA-C-N 116.182 -0.463 . . . . 72.55 110.958 -179.868 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.695 HD12 ' NE2' ' A' ' 16' ' ' GLN . 1.3 tt . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.77 0.319 . . . . 72.52 110.861 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.445 ' N ' HD23 ' A' ' 35' ' ' LEU . 1.1 tp10 -57.24 -52.64 64.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.268 -0.424 . . . . 73.13 110.931 179.911 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.48 -36.76 84.83 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.153 -0.476 . . . . 63.32 111.1 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.459 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 2.7 mmtm -65.19 -49.13 70.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.189 -0.46 . . . . 72.32 110.861 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 35' ' ' LEU . 4.6 mt -62.64 -35.54 79.93 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.209 -0.45 . . . . 72.11 110.874 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 26.0 tttt -60.1 -45.6 92.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.191 -0.459 . . . . 62.43 110.888 179.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.459 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 1.7 pt-20 -60.56 -32.73 71.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.192 -0.458 . . . . 75.11 110.877 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.537 ' HE2' HD11 ' A' ' 61' ' ' ILE . 13.9 ttt -65.68 -34.05 77.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.145 -0.48 . . . . 63.43 110.887 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.752 ' OE1' HD11 ' A' ' 48' ' ' LEU . 2.7 mm-40 -64.11 -39.65 94.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.239 -0.437 . . . . 74.45 110.847 -179.929 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.2 mmpt? -68.52 -29.21 67.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.192 -0.458 . . . . 71.43 110.915 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -70.05 -42.31 73.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 73.32 110.923 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.584 ' HB3' HD23 ' A' ' 48' ' ' LEU . 10.4 m-85 -82.1 -35.33 28.7 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.206 -0.452 . . . . 70.43 110.803 -179.871 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.402 ' HA3' ' HB2' ' A' ' 206' ' ' SER . . . 104.74 -10.15 48.68 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.718 -0.753 . . . . 64.34 112.414 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.752 HD11 ' OE1' ' A' ' 43' ' ' GLN . 0.7 OUTLIER -60.66 138.57 93.05 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.607 0.718 . . . . 64.11 110.941 -179.927 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.702 ' O ' HG23 ' A' ' 51' ' ' THR . 53.9 Cg_endo -69.73 -53.25 0.28 Allowed 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.643 2.229 . . . . 74.5 112.386 179.844 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.438 ' O ' HD12 ' A' ' 48' ' ' LEU . 0.9 OUTLIER -52.39 108.23 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.242 -0.435 . . . . 71.22 111.137 179.847 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.702 HG23 ' O ' ' A' ' 49' ' ' PRO . 68.2 p -116.22 168.53 10.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.214 -0.448 . . . . 73.25 111.174 179.917 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 65.19 12.51 55.52 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.763 -0.732 . . . . 64.24 112.495 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.2 ppp? -124.72 161.12 27.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.836 0.35 . . . . 75.23 110.868 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.546 HD21 ' CB ' ' A' ' 15' ' ' ALA . 18.4 tp -162.53 94.03 0.86 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.213 -0.449 . . . . 73.4 110.933 179.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.413 ' HA ' HG13 ' A' ' 59' ' ' ILE . 0.6 OUTLIER 172.9 -26.13 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.122 -0.49 . . . . 44.35 110.927 179.963 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 44.3 m -89.34 -100.5 0.09 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.171 -0.468 . . . . 75.25 110.851 -179.819 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 12.9 tpt180 -84.62 -28.23 26.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.126 -0.488 . . . . 61.22 110.874 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.495 HG21 HE22 ' A' ' 43' ' ' GLN . 97.3 t -62.68 -41.33 91.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.218 -0.446 . . . . 70.12 111.112 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.427 HD11 ' HB2' ' A' ' 15' ' ' ALA . 1.8 mm -74.97 -31.58 25.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.177 -0.465 . . . . 74.43 111.167 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -60.06 -44.12 94.95 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 73.45 110.86 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.653 HG21 HG23 ' A' ' 215' ' ' THR . 24.4 pt -70.34 -30.01 41.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.175 -0.466 . . . . 74.52 111.147 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . 0.646 ' HE3' ' HB1' ' A' ' 15' ' ' ALA . 2.1 mmm -67.77 -35.26 78.38 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.144 -0.48 . . . . 74.01 110.832 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -87.67 -24.06 24.02 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.209 -0.451 . . . . 42.22 110.861 -179.874 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 50.5 mtmt -85.02 113.88 52.61 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.596 0.712 . . . . 65.34 110.864 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.78 148.05 64.07 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.71 2.273 . . . . 72.11 112.361 179.881 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.563 ' O ' HD23 ' A' ' 156' ' ' LEU . 1.5 ppt_? -154.7 -59.48 0.11 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.252 -0.431 . . . . 71.51 110.829 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -146.14 144.88 30.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.215 -0.448 . . . . 55.3 110.884 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.554 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -101.75 15.37 57.09 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.781 -0.723 . . . . 64.23 112.491 -179.922 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.598 HG12 ' HD2' ' A' ' 70' ' ' PRO . 0.1 OUTLIER -101.86 137.0 19.41 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.642 0.734 . . . . 74.23 111.111 -179.982 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . 0.598 ' HD2' HG12 ' A' ' 69' ' ' VAL . 54.2 Cg_endo -69.82 165.41 31.12 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.632 2.221 . . . . 63.44 112.387 179.904 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -135.01 46.27 2.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.253 -0.43 . . . . 74.45 110.867 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.263 -0.426 . . . . 53.43 111.066 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo . . . . . 0 C--O 1.231 0.172 0 CA-C-O 120.798 0.249 . . . . 71.11 112.308 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.821 ' HD2' HD22 ' A' ' 237' ' ' LEU . 5.4 mttp -63.34 151.02 41.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.269 -0.423 . . . . 64.45 110.898 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . 0.686 ' CE3' HG21 ' A' ' 89' ' ' VAL . 39.7 m0 -50.97 109.49 0.33 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.198 -0.455 . . . . 73.31 110.961 179.902 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -105.02 -14.7 15.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.25 -0.432 . . . . 65.3 111.183 -179.957 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -58.16 153.5 14.82 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.188 -0.46 . . . . 70.34 110.897 -179.879 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 14.6 mmtp -65.91 -30.62 71.24 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.178 -0.465 . . . . 71.12 110.91 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.419 HG23 ' CD2' ' A' ' 123' ' ' HIS . 0.8 OUTLIER -154.79 142.25 12.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.208 -0.451 . . . . 74.14 111.132 179.934 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.686 HG21 ' CE3' ' A' ' 84' ' ' TRP . 54.8 t -123.61 139.21 50.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.183 -0.462 . . . . 72.25 111.082 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.488 ' C ' ' HB1' ' A' ' 132' ' ' ALA . 31.6 p -115.96 147.12 41.5 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.113 -0.494 . . . . 71.01 111.099 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 17.5 p90 -131.36 146.6 52.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.21 -0.45 . . . . 70.51 110.971 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 9.1 ttt180 -147.71 138.47 23.31 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.082 -0.508 . . . . 71.25 110.897 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.517 HD11 ' HA ' ' A' ' 106' ' ' ASP . 9.8 mm -75.21 135.09 27.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.223 -0.444 . . . . 72.4 111.156 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.456 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 21.1 t -91.47 -40.27 12.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.187 -0.461 . . . . 60.2 111.142 179.829 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 35.1 t -151.05 169.36 22.02 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.196 -0.456 . . . . 64.24 110.807 -179.835 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 13.2 p90 -131.86 155.09 48.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.078 -0.51 . . . . 72.25 110.95 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.7 t -103.32 141.71 35.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.129 -0.487 . . . . 64.11 111.14 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 2.1 mmt180 -52.53 -18.45 1.72 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.214 -0.448 . . . . 72.14 110.842 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.03 -37.42 87.54 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.199 -0.455 . . . . 74.13 110.86 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.617 HD11 ' HA ' ' A' ' 179' ' ' THR . 0.9 OUTLIER -142.09 152.4 61.45 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.594 0.711 . . . . 72.52 110.895 -179.957 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . 0.567 ' HB2' HG22 ' A' ' 103' ' ' ILE . 54.4 Cg_endo -69.71 151.21 69.3 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.724 2.283 . . . . 73.11 112.311 179.832 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -52.96 -26.29 14.68 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.196 -0.457 . . . . 74.11 110.814 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.567 HG22 ' HB2' ' A' ' 101' ' ' PRO . 5.5 tt -77.1 -39.51 29.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.312 -0.403 . . . . 74.02 111.124 179.9 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . 0.785 ' O ' HD22 ' A' ' 108' ' ' LEU . 3.4 m -69.12 -36.79 77.87 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.241 -0.436 . . . . 52.11 111.177 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.8 HG13 ' CZ ' ' A' ' 188' ' ' PHE . 57.5 t -71.27 -42.15 74.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.172 -0.467 . . . . 71.51 111.165 179.853 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.645 ' O ' HG22 ' A' ' 109' ' ' VAL . 22.9 t0 -68.66 -38.21 80.25 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.217 -0.447 . . . . 63.44 110.928 179.888 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . 0.483 ' HG3' ' N ' ' A' ' 108' ' ' LEU . 0.0 OUTLIER -70.0 -33.49 72.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.153 -0.476 . . . . 75.02 110.869 -179.869 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.785 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -64.64 -47.76 77.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.188 -0.46 . . . . 71.04 110.993 179.929 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.748 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.3 m -55.16 -41.32 59.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 72.31 111.201 179.797 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.464 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 44.8 t -70.0 -34.67 73.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.174 -0.466 . . . . 72.14 110.892 -179.906 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.451 ' CG ' HD21 ' A' ' 189' ' ' LEU . 0.3 OUTLIER -63.46 -34.64 78.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.11 -0.496 . . . . 74.35 110.887 179.948 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -92.27 -40.42 10.96 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.233 -0.44 . . . . 74.32 111.069 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 1.055 HD13 HD12 ' A' ' 196' ' ' LEU . 9.2 tp -64.4 -32.59 74.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.224 -0.444 . . . . 72.0 110.977 179.974 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 39.7 t30 -66.66 -38.77 87.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.209 -0.45 . . . . 72.34 110.886 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . 0.734 ' O ' HD11 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -60.84 -34.7 74.97 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.167 -0.469 . . . . 54.12 110.906 179.906 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' TRP . . . . . 0.407 ' O ' HG12 ' A' ' 120' ' ' ILE . 8.7 m95 -68.52 -38.81 81.22 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.186 -0.461 . . . . 75.23 110.872 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' GLY . . . . . 0.451 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -73.64 -33.91 57.48 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.76 -0.733 . . . . 73.32 112.456 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.7 -15.04 57.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.722 0.296 . . . . 72.42 110.863 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.807 ' HB2' HG23 ' A' ' 231' ' ' ILE . 5.1 pt-20 -106.25 13.56 28.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.264 -0.426 . . . . 75.24 110.954 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 0.998 HD12 HD12 ' A' ' 122' ' ' LEU . 7.3 pt -149.79 142.48 15.83 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.635 0.731 . . . . 71.34 111.157 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -69.86 25.32 0.18 Allowed 'Trans proline' 0 C--O 1.232 0.201 0 C-N-CA 122.641 2.228 . . . . 72.21 112.321 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.998 HD12 HD12 ' A' ' 120' ' ' ILE . 14.3 mt -81.49 -159.42 0.27 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.206 -0.452 . . . . 73.22 110.934 179.97 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.456 ' H ' ' HB3' ' A' ' 122' ' ' LEU . 4.1 t60 -157.25 137.26 12.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.237 -0.438 . . . . 74.12 110.929 179.857 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . 0.411 ' CE2' ' HA3' ' A' ' 117' ' ' GLY . 20.9 m-85 -117.68 138.23 52.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.197 -0.456 . . . . 75.54 110.931 -179.897 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -118.27 141.48 48.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.149 -0.478 . . . . 75.14 110.821 -179.815 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.55 154.63 27.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.171 -0.468 . . . . 72.22 110.915 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . 0.718 HG11 ' HB2' ' A' ' 132' ' ' ALA . 19.5 m -103.38 126.91 57.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.189 -0.46 . . . . 50.13 111.132 179.894 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.427 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -145.13 -25.99 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.208 -0.451 . . . . 74.43 111.152 179.901 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' TRP . . . . . 0.427 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -139.76 109.27 6.22 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.176 -0.465 . . . . 71.25 110.877 179.954 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 103.0 -167.48 17.17 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.682 -0.77 . . . . 62.11 112.469 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -101.76 156.15 17.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.741 0.305 . . . . 63.25 111.158 -179.842 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . 0.718 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -111.72 165.29 12.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.246 -0.433 . . . . 51.34 111.135 179.858 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -74.45 -44.57 51.12 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.242 -0.436 . . . . 75.41 110.893 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . 0.606 HG23 ' O ' ' A' ' 168' ' ' GLY . 3.8 mm -89.39 113.3 25.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 70.51 111.172 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . 0.456 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 8.4 mmm -101.82 122.59 44.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.177 -0.465 . . . . 72.43 110.877 179.864 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -107.0 93.42 2.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 70.04 111.123 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -130.17 173.1 20.03 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.709 -0.757 . . . . 63.34 112.418 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 138' ' ' PHE . . . . . 0.553 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 51.4 m-85 -108.48 149.83 28.26 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.854 0.359 . . . . 74.01 110.904 -179.877 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.553 ' HB2' ' O ' ' A' ' 138' ' ' PHE . . . 170.35 166.12 0.07 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.165 -0.47 . . . . 71.21 111.118 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.45 ' HB2' ' CB ' ' A' ' 149' ' ' PHE . 1.9 ptt180 -109.59 174.14 6.0 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.234 -0.439 . . . . 62.21 110.908 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . 0.452 ' H ' ' HA ' ' A' ' 149' ' ' PHE . . . -55.34 -18.93 15.53 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.676 -0.773 . . . . 74.24 112.53 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 142' ' ' ALA . . . . . 0.461 ' HB2' ' HD2' ' A' ' 149' ' ' PHE . . . -91.43 13.18 18.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.793 0.33 . . . . 75.03 111.082 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 143' ' ' HIS . . . . . 0.517 ' HB3' ' HB1' ' A' ' 139' ' ' ALA . 2.2 p80 -77.91 -15.75 58.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.212 -0.449 . . . . 71.11 110.855 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 128.27 49.62 0.15 Allowed Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.74 -0.743 . . . . 45.51 112.492 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -153.26 169.55 22.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.827 0.346 . . . . 72.14 110.863 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.38 165.47 11.81 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.216 -0.447 . . . . 51.25 110.902 -179.799 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 12.6 m-85 64.75 134.07 0.04 OUTLIER Pre-proline 0 C--N 1.327 -0.377 0 CA-C-O 121.724 0.773 . . . . 73.4 110.919 -179.843 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 151.35 68.85 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.674 2.249 . . . . 74.53 112.337 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 149' ' ' PHE . . . . . 0.461 ' HD2' ' HB2' ' A' ' 142' ' ' ALA . 10.4 p90 -53.19 -44.63 68.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.265 -0.425 . . . . 63.52 110.861 -179.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 75.52 -21.23 0.31 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.088 -0.506 . . . . 63.11 110.882 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . 0.45 ' H ' ' C ' ' A' ' 149' ' ' PHE . . . 68.04 -139.83 35.06 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.726 -0.749 . . . . 71.41 112.434 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.69 142.43 48.2 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.647 2.231 . . . . 75.11 112.357 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . 0.449 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 104.38 -143.47 15.69 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.768 -0.73 . . . . 70.32 112.437 179.918 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 154' ' ' ASN . . . . . 0.449 ' C ' ' O ' ' A' ' 153' ' ' GLY . 4.1 p30 -34.52 141.23 0.06 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.922 0.392 . . . . 73.25 110.867 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 75.72 117.88 0.06 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.126 -0.488 . . . . 44.41 111.098 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 156' ' ' LEU . . . . . 1.047 HD21 HG21 ' A' ' 186' ' ' ILE . 1.2 tp -107.07 -51.8 2.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.464 . . . . 75.02 110.955 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . 0.554 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -154.67 149.58 26.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.209 -0.45 . . . . 71.42 111.025 179.787 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 29.3 p-80 -116.39 110.94 19.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.172 -0.467 . . . . 72.02 110.816 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -110.95 170.3 8.19 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.313 -0.403 . . . . 74.42 111.118 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -146.65 164.35 32.94 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.208 -0.451 . . . . 75.31 110.868 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 161' ' ' ALA . . . . . 0.729 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -93.74 164.99 18.96 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.498 0.666 . . . . 61.04 111.16 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 162' ' ' PRO . . . . . 0.729 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 54.1 Cg_endo -69.76 77.23 1.08 Allowed 'Trans proline' 0 C--O 1.231 0.169 0 C-N-CA 122.726 2.284 . . . . 74.44 112.35 -179.942 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -112.41 120.42 5.29 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.741 -0.742 . . . . 61.41 112.457 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 1.2 m 76.17 -58.97 0.52 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.789 0.328 . . . . 73.1 111.148 -179.827 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . 172.1 -56.49 0.17 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.784 -0.722 . . . . 74.03 112.483 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 166' ' ' LEU . . . . . 0.461 HD23 ' O ' ' A' ' 166' ' ' LEU . 1.3 tt -60.81 -18.08 53.37 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.83 0.348 . . . . 65.12 110.925 -179.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -71.03 176.91 36.25 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.757 -0.735 . . . . 43.43 112.494 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 168' ' ' GLY . . . . . 0.606 ' O ' HG23 ' A' ' 134' ' ' ILE . . . 76.47 13.63 83.22 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.711 -0.757 . . . . 74.31 112.536 -179.88 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -94.05 149.69 21.01 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.822 0.344 . . . . 63.41 110.887 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.33 130.9 55.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.249 -0.432 . . . . 74.21 111.148 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 171' ' ' HIS . . . . . 0.448 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 62.9 m170 -128.05 132.75 49.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.218 -0.446 . . . . 72.53 110.906 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 30.3 m-85 -112.04 139.2 47.75 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.216 -0.447 . . . . 71.44 110.919 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -70.22 99.74 1.57 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.206 -0.452 . . . . 74.11 110.869 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.78 -16.67 12.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.231 -0.441 . . . . 72.25 110.893 -179.896 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 -76.25 -16.07 59.88 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.182 -0.463 . . . . 73.32 110.859 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -87.95 -176.22 5.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 63.2 110.88 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 48.0 mtm180 -110.83 119.74 40.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.158 -0.474 . . . . 63.14 110.93 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 48.9 m95 -117.04 139.16 51.03 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.256 -0.429 . . . . 72.31 110.934 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 179' ' ' THR . . . . . 0.617 ' HA ' HD11 ' A' ' 100' ' ' LEU . 7.1 t -177.33 163.51 2.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.267 -0.424 . . . . 74.13 111.151 -179.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -125.65 -68.55 0.83 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.233 -0.44 . . . . 45.33 110.916 179.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -65.26 -11.16 51.34 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.745 -0.74 . . . . 62.41 112.416 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 182' ' ' SER . . . . . 0.46 ' HB2' HG21 ' A' ' 179' ' ' THR . 1.5 m -97.34 -24.42 15.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.833 0.349 . . . . 64.5 110.907 -179.831 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 183' ' ' SER . . . . . 0.438 ' C ' ' O ' ' A' ' 182' ' ' SER . 12.1 m 34.82 61.76 0.57 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.147 -0.479 . . . . 64.12 110.88 -179.824 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -116.9 -33.59 4.71 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.067 -0.515 . . . . 74.2 110.942 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -122.3 -136.38 4.9 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.671 -0.776 . . . . 73.01 112.442 179.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 186' ' ' ILE . . . . . 1.047 HG21 HD21 ' A' ' 156' ' ' LEU . 8.2 mm -79.41 99.53 3.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.814 0.34 . . . . 73.22 111.138 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -50.29 121.79 6.06 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.18 -0.464 . . . . 71.31 110.844 -179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 188' ' ' PHE . . . . . 0.8 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.7 t80 -53.85 -34.84 60.54 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.207 -0.451 . . . . 75.45 110.905 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . 0.451 HD21 ' CG ' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -67.25 -47.46 70.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 52.02 110.905 -179.966 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 13.1 m-30 -69.47 -41.44 76.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.226 -0.443 . . . . 74.22 110.893 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 191' ' ' ALA . . . . . 0.611 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -68.38 -35.91 78.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.177 -0.465 . . . . 50.03 111.094 179.846 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 192' ' ' ALA . . . . . 0.66 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -58.56 -44.61 89.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.199 -0.455 . . . . 52.11 111.125 179.919 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 193' ' ' THR . . . . . 0.5 HG21 HG21 ' A' ' 211' ' ' VAL . 0.9 OUTLIER -58.24 -42.9 87.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.152 -0.476 . . . . 72.43 111.178 -179.904 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 8.0 t-160 -72.84 -41.64 64.59 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.215 -0.448 . . . . 71.44 110.876 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -71.44 -47.92 52.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 71.01 111.095 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 196' ' ' LEU . . . . . 1.055 HD12 HD13 ' A' ' 113' ' ' LEU . 4.4 mm? -63.82 -44.34 93.54 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.312 -0.404 . . . . 74.51 110.955 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -58.85 -27.47 61.94 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.698 -0.763 . . . . 52.23 112.552 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 198' ' ' HIS . . . . . 0.407 ' CD2' HG21 ' A' ' 69' ' ' VAL . 4.9 m-70 -67.38 -43.79 80.52 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.778 0.323 . . . . 75.21 110.909 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.15 -26.33 64.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.232 -0.44 . . . . 71.13 110.855 -179.794 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -83.98 2.96 36.38 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.138 -0.483 . . . . 64.13 110.926 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 83.52 -8.04 66.55 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.759 -0.734 . . . . 50.41 112.469 179.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 202' ' ' MET . . . . . 0.555 ' SD ' HD12 ' A' ' 234' ' ' ILE . 0.0 OUTLIER -49.84 134.84 20.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.833 0.349 . . . . 63.21 110.85 -179.975 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -102.66 159.1 17.72 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.727 -0.749 . . . . 64.44 112.468 -179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 29.2 m-70 -58.7 158.26 8.21 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.786 0.327 . . . . 74.32 110.899 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -124.09 138.97 54.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.253 -0.43 . . . . 53.34 110.939 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 206' ' ' SER . . . . . 0.402 ' HB2' ' HA3' ' A' ' 47' ' ' GLY . 3.1 p -76.79 -4.46 43.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.131 -0.486 . . . . 72.22 110.829 -179.742 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.71 135.09 83.58 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.624 0.726 . . . . 65.11 110.899 179.904 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.72 -6.3 18.26 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.709 2.273 . . . . 74.53 112.328 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -123.1 22.89 9.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.222 -0.444 . . . . 63.52 110.942 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 210' ' ' ALA . . . . . 0.494 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.13 145.63 26.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.15 -0.477 . . . . 62.23 111.144 179.851 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 211' ' ' VAL . . . . . 0.5 HG21 HG21 ' A' ' 193' ' ' THR . 0.4 OUTLIER -69.56 -28.05 36.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.261 -0.427 . . . . 62.04 111.06 -179.987 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 8.5 mmm -95.4 12.91 27.59 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.197 -0.456 . . . . 75.22 110.871 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 213' ' ' TYR . . . . . 0.417 ' CE2' ' HB ' ' A' ' 215' ' ' THR . 1.9 t80 -54.88 112.29 3.9 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-O 121.672 0.748 . . . . 73.43 110.898 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 214' ' ' PRO . . . . . 0.415 ' HD2' ' HA ' ' A' ' 213' ' ' TYR . 53.9 Cg_endo -69.82 -17.62 37.18 Favored 'Trans proline' 0 C--O 1.233 0.234 0 C-N-CA 122.698 2.266 . . . . 63.01 112.285 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 215' ' ' THR . . . . . 0.653 HG23 HG21 ' A' ' 61' ' ' ILE . 0.2 OUTLIER -83.48 59.53 5.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.29 -0.414 . . . . 74.24 111.127 -179.956 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.223 -0.444 . . . . 74.14 110.861 -179.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.526 0.055 0 CA-C-O 120.993 0.425 . . . . 65.01 110.823 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.92 163.43 32.82 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.08 -0.509 . . . . 64.24 110.851 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 226' ' ' LEU . . . . . 0.734 HD11 ' O ' ' A' ' 115' ' ' MET . 11.5 mt -60.75 148.98 37.06 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.199 -0.455 . . . . 53.44 110.951 179.863 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 227' ' ' SER . . . . . 0.494 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 1.2 t -87.51 151.89 22.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.231 -0.441 . . . . 74.21 110.804 -179.882 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 19.7 tt0 -62.34 -66.07 0.59 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.146 -0.479 . . . . 74.54 110.809 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -55.55 -26.19 41.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.191 -0.459 . . . . 72.22 110.885 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -69.15 -48.12 63.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.179 -0.464 . . . . 74.23 110.867 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 231' ' ' ILE . . . . . 0.807 HG23 ' HB2' ' A' ' 119' ' ' GLU . 7.9 mt -68.3 -43.21 84.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.197 -0.456 . . . . 73.41 111.059 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 2.0 pttp -62.84 -31.85 72.95 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.232 -0.44 . . . . 65.42 110.915 179.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -62.62 -49.95 68.68 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.813 -0.708 . . . . 63.43 112.473 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 234' ' ' ILE . . . . . 0.555 HD12 ' SD ' ' A' ' 202' ' ' MET . 6.7 tt -73.07 -30.83 32.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.865 0.364 . . . . 71.54 111.174 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -68.67 -24.03 64.47 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.123 -0.489 . . . . 70.33 110.977 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 236' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.76 -28.17 60.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.126 -0.488 . . . . 51.21 110.915 179.911 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 237' ' ' LEU . . . . . 0.821 HD22 ' HD2' ' A' ' 83' ' ' LYS . 10.3 tt -98.02 -29.36 13.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.149 -0.478 . . . . 75.41 110.889 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 238' ' ' TYR . . . . . 0.492 ' CE2' HD11 ' A' ' 122' ' ' LEU . 27.9 m-85 -91.99 -35.46 13.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.245 -0.434 . . . . 51.24 110.916 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.388 0 C-N-CA 120.784 -0.722 . . . . 32.22 112.479 179.962 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 19.4 t-105 . . . . . 0 C--O 1.23 0.071 0 CA-C-O 120.741 0.305 . . . . 71.22 110.886 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -72.26 -42.2 65.89 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.19 -0.459 . . . . 72.51 110.892 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -63.54 -36.85 85.15 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.156 -0.475 . . . . 61.24 110.944 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.19 -34.85 68.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.113 -0.494 . . . . 54.34 111.104 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -69.88 -37.83 76.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.242 -0.435 . . . . 73.12 110.987 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.406 ' HA ' ' HD2' ' A' ' 20' ' ' LYS . 1.9 m-20 -77.47 -31.56 53.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.179 -0.464 . . . . 72.4 110.811 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 4.0 m-30 -59.79 -36.09 75.99 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.212 -0.449 . . . . 75.11 110.897 -179.794 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.656 HD13 ' O ' ' A' ' 19' ' ' LEU . 2.9 tm? -72.11 -21.01 61.54 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.146 -0.479 . . . . 72.51 110.876 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.406 ' HD2' ' HA ' ' A' ' 17' ' ' ASP . 1.4 ptmt -77.62 -26.56 50.65 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.219 -0.446 . . . . 74.41 110.901 179.84 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.425 ' HG3' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -83.83 -27.85 28.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.444 . . . . 74.05 110.871 -179.989 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.425 ' N ' ' HG3' ' A' ' 21' ' ' ARG . 2.7 m-85 -60.79 -22.36 64.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.196 -0.456 . . . . 74.31 110.868 -179.898 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 . . . . . 0 C--N 1.328 -0.35 0 CA-C-N 116.206 -0.452 . . . . 72.55 110.899 -179.845 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.525 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 1.8 mm? . . . . . 0 C--O 1.23 0.062 0 CA-C-O 120.782 0.325 . . . . 72.52 110.922 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.64 -50.87 71.73 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.211 -0.449 . . . . 73.13 110.943 179.858 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.56 -36.76 84.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.122 -0.49 . . . . 63.32 111.103 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.494 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.7 OUTLIER -68.66 -49.75 56.62 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.181 -0.463 . . . . 72.32 110.865 -179.995 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' A' ' 35' ' ' LEU . 7.0 mt -56.44 -36.89 69.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.28 -0.418 . . . . 72.11 110.919 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.9 mttt -58.52 -45.56 88.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.146 -0.479 . . . . 62.43 110.878 179.856 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.494 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 2.3 pt-20 -60.43 -32.58 71.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.254 -0.43 . . . . 75.11 110.919 179.931 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.3 tmt? -68.25 -34.36 76.05 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.12 -0.491 . . . . 63.43 110.914 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.784 ' OE1' HD11 ' A' ' 48' ' ' LEU . 6.8 mm-40 -57.14 -39.64 75.6 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.265 -0.425 . . . . 74.45 110.952 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.4 mmpt? -69.9 -28.27 65.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.137 -0.483 . . . . 71.43 110.947 179.9 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 43.6 t80 -70.37 -37.56 74.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.175 -0.466 . . . . 73.32 110.895 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.722 ' HB3' HD23 ' A' ' 48' ' ' LEU . 3.0 m-85 -81.84 -35.04 29.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.158 -0.474 . . . . 70.43 110.898 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.42 ' HA2' ' HB3' ' A' ' 206' ' ' SER . . . 106.06 -10.27 43.84 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.804 -0.712 . . . . 64.34 112.478 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.784 HD11 ' OE1' ' A' ' 43' ' ' GLN . 0.8 OUTLIER -65.68 139.11 96.91 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.603 0.716 . . . . 64.11 110.931 -179.937 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.462 ' HG2' HD13 ' A' ' 50' ' ' ILE . 54.4 Cg_endo -69.72 -51.98 0.36 Allowed 'Trans proline' 0 C--O 1.232 0.22 0 C-N-CA 122.67 2.246 . . . . 74.5 112.329 179.833 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.488 ' O ' HD12 ' A' ' 48' ' ' LEU . 0.0 OUTLIER -53.01 108.15 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.223 -0.444 . . . . 71.22 111.133 179.962 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.404 ' HA ' ' HG3' ' A' ' 43' ' ' GLN . 3.7 t -119.75 155.96 31.47 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.178 -0.465 . . . . 73.25 111.109 179.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.54 -7.58 57.39 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.774 -0.727 . . . . 64.24 112.435 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 15.3 mtt -135.1 161.17 36.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.789 0.328 . . . . 75.23 110.853 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.422 ' HA ' ' HB ' ' A' ' 58' ' ' VAL . 2.8 pp -156.59 128.97 7.53 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.169 -0.469 . . . . 73.4 110.941 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 176.2 -30.31 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 44.35 110.852 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 20.4 p -93.51 -88.48 0.23 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.218 -0.446 . . . . 75.25 110.821 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 2.9 mmm180 -84.71 -35.55 22.44 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.131 -0.486 . . . . 61.22 110.832 -179.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.422 ' HB ' ' HA ' ' A' ' 54' ' ' LEU . 16.6 t -60.64 -43.71 95.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.169 -0.469 . . . . 70.12 111.122 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -74.82 -31.25 25.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.244 -0.434 . . . . 74.43 111.155 179.951 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -67.17 -44.13 80.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.132 -0.485 . . . . 73.45 110.982 179.87 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.562 HD12 ' CZ ' ' A' ' 46' ' ' PHE . 37.3 pt -66.89 -30.06 48.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.184 -0.462 . . . . 74.52 111.107 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -58.47 -40.67 83.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.181 -0.463 . . . . 74.01 110.893 179.888 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 16.0 pt20 -91.66 -23.94 19.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.29 -0.414 . . . . 42.22 110.905 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 4.2 ttmm -78.8 114.43 43.79 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.549 0.69 . . . . 65.34 110.906 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.85 140.22 41.82 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.668 2.246 . . . . 72.11 112.268 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.561 ' O ' HD23 ' A' ' 156' ' ' LEU . 1.0 OUTLIER -140.78 -61.69 0.49 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.157 -0.474 . . . . 71.51 110.873 -179.961 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -145.46 151.17 37.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.157 -0.474 . . . . 55.3 110.848 -179.93 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.545 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -109.51 24.27 20.46 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.677 -0.773 . . . . 64.23 112.437 -179.943 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.616 HG12 ' HD2' ' A' ' 70' ' ' PRO . 0.2 OUTLIER -103.17 137.51 19.28 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.527 0.68 . . . . 74.23 111.177 -179.978 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . 0.616 ' HD2' HG12 ' A' ' 69' ' ' VAL . 53.9 Cg_endo -69.69 141.92 46.84 Favored 'Trans proline' 0 N--CA 1.465 -0.152 0 C-N-CA 122.721 2.281 . . . . 63.44 112.33 179.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -94.78 22.67 6.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.47 . . . . 74.45 110.908 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.141 -0.481 . . . . 53.43 111.092 179.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.401 ' HB2' ' HD3' ' A' ' 83' ' ' LYS . 53.9 Cg_endo . . . . . 0 C--O 1.231 0.175 0 CA-C-O 120.898 0.291 . . . . 71.11 112.302 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.742 ' CD ' HD22 ' A' ' 237' ' ' LEU . 0.0 OUTLIER -132.38 -172.18 2.83 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.182 -0.463 . . . . 64.45 110.909 179.931 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . 0.428 ' CE2' ' HB3' ' A' ' 162' ' ' PRO . 61.0 m95 -64.68 140.32 58.86 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.255 -0.43 . . . . 73.31 110.915 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.15 -2.29 12.78 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.236 -0.438 . . . . 65.3 111.184 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.6 m -72.52 -178.87 2.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.134 -0.485 . . . . 70.34 110.872 -179.883 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.92 -15.98 18.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.121 -0.49 . . . . 71.12 110.882 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -155.67 143.37 11.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.243 -0.435 . . . . 74.14 111.176 179.871 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 6.5 t -118.92 130.26 73.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.2 -0.455 . . . . 72.25 111.132 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.63 HG22 ' HB3' ' A' ' 125' ' ' ARG . 21.9 p -119.88 165.92 13.98 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.161 -0.472 . . . . 71.01 111.149 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 3.1 p90 -151.45 146.48 25.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.211 -0.449 . . . . 70.51 110.901 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 4.0 ttt180 -149.17 131.68 15.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.142 -0.481 . . . . 71.25 110.852 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.562 HG23 ' O ' ' A' ' 136' ' ' ILE . 5.0 mp -75.27 132.87 32.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.132 -0.485 . . . . 72.4 111.162 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.431 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 22.0 t -84.99 -40.29 14.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.166 -0.47 . . . . 60.2 111.111 179.897 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 84.5 p -159.15 169.41 24.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.15 -0.477 . . . . 64.24 110.889 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 12.6 p90 -123.61 155.15 38.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.126 -0.488 . . . . 72.25 110.932 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 5.3 t -94.12 141.19 28.83 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.144 -0.48 . . . . 64.11 111.16 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.7 -18.7 1.94 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.236 -0.438 . . . . 72.14 110.894 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.25 -36.93 85.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.169 -0.468 . . . . 74.13 110.818 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.704 HD22 HG21 ' A' ' 104' ' ' THR . 1.2 mt -140.15 153.47 69.16 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.54 0.686 . . . . 72.52 110.952 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . 0.567 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.4 Cg_endo -69.81 150.98 68.63 Favored 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.629 2.219 . . . . 73.11 112.324 179.887 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 12.7 t-160 -52.22 -27.89 16.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.164 -0.471 . . . . 74.11 110.919 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.567 HG22 ' HB2' ' A' ' 101' ' ' PRO . 0.0 OUTLIER -75.03 -39.17 43.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.218 -0.446 . . . . 74.02 111.126 -179.992 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . 0.704 HG21 HD22 ' A' ' 100' ' ' LEU . 3.0 m -69.66 -39.11 77.25 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.157 -0.474 . . . . 52.11 111.14 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.777 ' O ' HG13 ' A' ' 109' ' ' VAL . 76.5 t -72.83 -46.22 53.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.187 -0.461 . . . . 71.51 111.11 179.93 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.683 ' O ' HG22 ' A' ' 109' ' ' VAL . 0.3 OUTLIER -60.74 -44.17 97.01 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.147 -0.479 . . . . 63.44 110.814 179.987 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 11.2 ptm180 -70.16 -34.11 72.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.198 -0.456 . . . . 75.02 110.838 -179.856 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.647 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -61.15 -48.26 82.4 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.17 -0.468 . . . . 71.04 110.877 -179.968 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.777 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.5 m -55.4 -41.61 63.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.244 -0.435 . . . . 72.31 111.087 179.846 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.469 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 10.7 t -70.11 -33.51 71.93 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.16 -0.473 . . . . 72.14 110.878 -179.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.43 ' HB3' HD21 ' A' ' 189' ' ' LEU . 0.4 OUTLIER -61.47 -32.86 72.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.105 -0.498 . . . . 74.35 110.957 179.931 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -97.14 -40.47 8.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.196 -0.457 . . . . 74.32 111.144 179.783 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.712 HD12 HD12 ' A' ' 196' ' ' LEU . 0.4 OUTLIER -65.38 -33.88 77.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.206 -0.452 . . . . 72.0 110.956 -180.0 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 36.7 t-20 -67.55 -35.71 79.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.177 -0.465 . . . . 72.34 110.812 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . 0.908 ' HB3' HD23 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -68.25 -33.6 74.67 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.226 -0.443 . . . . 54.12 110.89 179.888 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 6.0 m95 -68.55 -44.91 73.51 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.225 -0.443 . . . . 75.23 110.966 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -73.38 -40.43 48.45 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.695 -0.764 . . . . 73.32 112.532 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.416 ' HG2' ' O ' ' A' ' 115' ' ' MET . 4.5 ptpt -60.76 -16.93 45.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.709 0.29 . . . . 72.42 110.897 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.667 ' HB3' HG23 ' A' ' 231' ' ' ILE . 27.9 mm-40 -98.26 13.51 31.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.205 -0.452 . . . . 75.24 110.902 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 0.988 HD12 HD12 ' A' ' 122' ' ' LEU . 6.1 pt -147.64 150.31 36.31 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.561 0.696 . . . . 71.34 111.162 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.85 6.75 1.22 Allowed 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.662 2.242 . . . . 72.21 112.326 179.901 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.988 HD12 HD12 ' A' ' 120' ' ' ILE . 10.2 mt -60.2 -160.37 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.259 -0.428 . . . . 73.22 110.882 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -154.31 121.29 5.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.199 -0.455 . . . . 74.12 110.848 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 10.0 m-30 -109.33 148.74 30.55 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.173 -0.467 . . . . 75.54 110.899 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.63 ' HB3' HG22 ' A' ' 90' ' ' THR . 0.1 OUTLIER -130.69 141.73 50.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.146 -0.479 . . . . 75.14 110.827 -179.884 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . 0.522 ' HE3' HG13 ' A' ' 128' ' ' VAL . 0.1 OUTLIER -80.93 147.5 30.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.148 -0.478 . . . . 72.22 110.911 179.928 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . 1.048 HG11 ' HB2' ' A' ' 132' ' ' ALA . 29.9 m -103.08 126.3 57.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.258 -0.428 . . . . 50.13 111.145 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.602 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -142.45 -10.3 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.12 -0.491 . . . . 74.43 111.17 179.854 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' TRP . . . . . 0.602 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -154.87 109.17 2.96 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.132 -0.486 . . . . 71.25 110.905 179.979 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.68 -159.72 14.33 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.722 -0.752 . . . . 62.11 112.457 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.3 p -101.82 156.33 17.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.852 0.358 . . . . 63.25 111.11 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . 1.048 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -111.61 165.26 12.17 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.176 -0.465 . . . . 51.34 111.053 179.915 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.06 -62.54 1.36 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.225 -0.443 . . . . 75.41 110.817 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . 0.435 HD12 ' O ' ' A' ' 90' ' ' THR . 4.6 mp -88.68 122.53 40.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 70.51 111.167 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . 0.431 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 14.3 mmm -100.58 125.79 46.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.149 -0.478 . . . . 72.43 110.829 179.882 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.562 ' O ' HG23 ' A' ' 93' ' ' ILE . 0.9 OUTLIER -105.92 94.97 3.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.165 -0.47 . . . . 70.04 111.113 179.989 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -129.7 167.71 21.43 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.742 -0.742 . . . . 63.34 112.462 179.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 138' ' ' PHE . . . . . 0.563 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 55.3 m-85 -105.1 145.47 30.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.849 0.357 . . . . 74.01 110.913 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.563 ' HB2' ' O ' ' A' ' 138' ' ' PHE . . . 169.72 166.11 0.05 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.12 -0.491 . . . . 71.21 111.102 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.434 ' HB2' ' HB3' ' A' ' 149' ' ' PHE . 0.0 OUTLIER -107.94 174.21 5.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.262 -0.426 . . . . 62.21 110.819 -179.926 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . 0.555 ' H ' ' HA ' ' A' ' 149' ' ' PHE . . . -55.67 -16.44 11.44 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.753 -0.737 . . . . 74.24 112.471 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 142' ' ' ALA . . . . . 0.531 ' HB2' ' HD2' ' A' ' 149' ' ' PHE . . . -94.12 13.12 24.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.828 0.347 . . . . 75.03 111.113 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 143' ' ' HIS . . . . . 0.556 ' CB ' ' HB1' ' A' ' 139' ' ' ALA . 3.2 p80 -79.42 -4.48 51.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.202 -0.453 . . . . 71.11 110.867 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 110.77 48.13 0.75 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.69 -0.767 . . . . 45.51 112.46 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -161.79 175.11 12.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.9 0.381 . . . . 72.14 110.818 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 69.9 p -63.81 175.22 1.19 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.154 -0.476 . . . . 51.25 110.862 -179.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 64.52 118.93 0.02 OUTLIER Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.743 0.782 . . . . 73.4 110.876 -179.882 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.72 151.18 69.26 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.654 2.236 . . . . 74.53 112.325 179.901 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 149' ' ' PHE . . . . . 0.555 ' HA ' ' H ' ' A' ' 141' ' ' GLY . 3.6 p90 -54.23 -38.38 65.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.231 -0.44 . . . . 63.52 110.844 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . 0.492 ' CG ' ' O ' ' A' ' 149' ' ' PHE . 2.7 p30 48.72 18.46 0.19 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.166 -0.47 . . . . 63.11 110.858 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . 0.42 ' C ' ' O ' ' A' ' 150' ' ' ASP . . . 36.44 -150.29 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.767 -0.73 . . . . 71.41 112.434 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.72 144.66 54.93 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.709 2.273 . . . . 75.11 112.289 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . 0.449 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 106.04 -138.14 14.18 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.737 -0.744 . . . . 70.32 112.447 179.904 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 154' ' ' ASN . . . . . 0.449 ' C ' ' O ' ' A' ' 153' ' ' GLY . 3.6 p30 -34.2 136.37 0.13 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.882 0.373 . . . . 73.25 110.881 -179.856 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 155' ' ' THR . . . . . 0.419 HG22 ' HA3' ' A' ' 68' ' ' GLY . 0.2 OUTLIER 75.56 110.56 0.07 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.185 -0.461 . . . . 44.41 111.15 179.992 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 156' ' ' LEU . . . . . 0.932 HD21 HG21 ' A' ' 186' ' ' ILE . 0.4 OUTLIER -91.17 -54.32 3.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.222 -0.445 . . . . 75.02 110.896 -179.979 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . 0.545 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -163.85 148.95 10.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.22 -0.446 . . . . 71.42 111.022 179.794 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 158' ' ' HIS . . . . . 0.415 ' O ' ' HB2' ' A' ' 171' ' ' HIS . 14.5 p-80 -107.54 125.38 51.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.155 -0.475 . . . . 72.02 110.908 179.943 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -110.54 155.09 22.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.229 -0.441 . . . . 74.42 111.1 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 16.7 m-85 -106.86 151.95 24.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.246 -0.434 . . . . 75.31 110.867 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 161' ' ' ALA . . . . . 0.713 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -78.52 164.75 54.29 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.626 0.727 . . . . 61.04 111.046 179.925 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 162' ' ' PRO . . . . . 0.713 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.2 Cg_endo -69.83 78.48 1.03 Allowed 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.688 2.259 . . . . 74.44 112.257 -179.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -130.45 119.87 2.87 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.73 -0.748 . . . . 61.41 112.422 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 50.85 -169.86 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.874 0.369 . . . . 73.1 111.101 -179.896 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -75.51 -54.57 5.45 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.752 -0.737 . . . . 74.03 112.508 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 166' ' ' LEU . . . . . 0.438 ' C ' HD23 ' A' ' 166' ' ' LEU . 10.1 tt -54.36 -40.15 67.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.863 0.364 . . . . 65.12 110.895 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -80.22 164.04 47.47 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.742 -0.742 . . . . 43.43 112.512 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 168' ' ' GLY . . . . . 0.403 ' O ' HG13 ' A' ' 134' ' ' ILE . . . 84.54 23.11 51.88 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.815 -0.707 . . . . 74.31 112.515 -179.85 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -91.3 163.52 14.19 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.736 0.303 . . . . 63.41 110.89 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.49 130.95 55.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.225 -0.443 . . . . 74.21 111.061 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 171' ' ' HIS . . . . . 0.415 ' HB2' ' O ' ' A' ' 158' ' ' HIS . 27.3 m170 -125.1 158.55 33.58 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 72.53 110.831 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 64.0 m-85 -142.26 137.37 30.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.251 -0.432 . . . . 71.44 110.904 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 55.2 t0 -69.08 99.23 1.07 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 74.11 110.82 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.58 -16.41 10.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.152 -0.476 . . . . 72.25 110.879 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -77.86 -16.32 58.37 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.163 -0.472 . . . . 73.32 110.783 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 23.6 mm-40 -83.38 -175.65 5.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.241 -0.436 . . . . 63.2 110.898 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 1.9 mtt180 -109.8 116.79 32.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.143 -0.481 . . . . 63.14 110.917 -179.888 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 51.0 m95 -116.61 141.18 48.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.253 -0.43 . . . . 72.31 110.919 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 179' ' ' THR . . . . . 0.645 ' HA ' HD11 ' A' ' 100' ' ' LEU . 2.0 t -177.61 164.36 2.02 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.19 -0.459 . . . . 74.13 111.129 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -124.59 -68.76 0.84 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.213 -0.449 . . . . 45.33 110.881 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -70.51 -10.88 67.54 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.712 -0.756 . . . . 62.41 112.501 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 182' ' ' SER . . . . . 0.483 ' O ' ' C ' ' A' ' 183' ' ' SER . 0.2 OUTLIER -97.01 -24.29 15.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.878 0.37 . . . . 64.5 110.84 -179.723 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 183' ' ' SER . . . . . 0.483 ' C ' ' O ' ' A' ' 182' ' ' SER . 7.4 p 31.84 71.56 0.08 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.172 -0.467 . . . . 64.12 110.854 -179.877 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 184' ' ' LEU . . . . . 0.42 HD23 ' CG2' ' A' ' 179' ' ' THR . 0.5 OUTLIER -117.09 -32.64 4.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.215 -0.448 . . . . 74.2 110.895 179.987 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -132.28 -127.23 2.8 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.812 -0.708 . . . . 73.01 112.529 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 186' ' ' ILE . . . . . 0.932 HG21 HD21 ' A' ' 156' ' ' LEU . 6.7 mm -79.53 99.81 3.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.823 0.344 . . . . 73.22 111.147 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -55.96 125.65 22.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.173 -0.467 . . . . 71.31 110.824 179.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 188' ' ' PHE . . . . . 0.722 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.1 t80 -53.85 -33.28 55.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.185 -0.461 . . . . 75.45 110.863 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . 0.43 HD21 ' HB3' ' A' ' 111' ' ' LYS . 0.2 OUTLIER -67.21 -47.62 70.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.193 -0.458 . . . . 52.02 110.907 -179.981 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 10.1 m-30 -69.98 -40.15 75.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.228 -0.442 . . . . 74.22 110.908 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 191' ' ' ALA . . . . . 0.568 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -70.22 -35.8 74.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.119 -0.491 . . . . 50.03 111.061 179.919 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 192' ' ' ALA . . . . . 0.714 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -56.93 -44.66 82.69 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.26 -0.427 . . . . 52.11 111.132 179.914 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.07 -41.51 83.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.207 -0.451 . . . . 72.43 111.164 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 5.0 t-160 -72.81 -41.73 64.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 71.44 110.844 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -71.56 -48.42 48.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.164 -0.471 . . . . 71.01 111.142 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 196' ' ' LEU . . . . . 0.714 HD23 ' O ' ' A' ' 192' ' ' ALA . 4.3 mm? -64.66 -42.02 95.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.232 -0.44 . . . . 74.51 110.885 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -60.11 -29.04 67.48 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.784 -0.722 . . . . 52.23 112.438 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 198' ' ' HIS . . . . . 0.61 ' CD2' HG21 ' A' ' 69' ' ' VAL . 6.1 m-70 -69.19 -33.95 74.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.876 0.37 . . . . 75.21 110.947 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -68.92 -21.37 64.22 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.179 -0.464 . . . . 71.13 110.818 -179.794 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 200' ' ' LEU . . . . . 0.418 ' HB2' ' HG2' ' A' ' 202' ' ' MET . 0.5 OUTLIER -88.0 -1.05 57.75 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.155 -0.475 . . . . 64.13 110.913 -179.974 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 84.3 8.97 82.75 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.721 -0.752 . . . . 50.41 112.501 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 202' ' ' MET . . . . . 0.657 ' SD ' HD12 ' A' ' 234' ' ' ILE . 97.3 mmm -71.19 159.27 34.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.885 0.374 . . . . 63.21 110.882 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -125.94 159.18 20.34 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.682 -0.77 . . . . 64.44 112.45 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 16.4 m-70 -50.67 161.05 0.37 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.842 0.354 . . . . 74.32 110.873 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -123.16 150.47 43.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.199 -0.455 . . . . 53.34 110.915 -179.832 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 206' ' ' SER . . . . . 0.42 ' HB3' ' HA2' ' A' ' 47' ' ' GLY . 0.9 OUTLIER -87.63 -4.67 58.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.154 -0.475 . . . . 72.22 110.864 -179.817 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.55 137.96 83.41 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 121.557 0.694 . . . . 65.11 110.859 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 -7.23 20.54 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.699 2.266 . . . . 74.53 112.317 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 -128.97 30.78 5.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.24 -0.436 . . . . 63.52 110.9 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -87.11 145.7 26.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.129 -0.487 . . . . 62.23 111.149 179.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -67.77 -27.72 39.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.231 -0.44 . . . . 62.04 111.109 -179.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 81.1 mtp -97.1 8.58 44.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.167 -0.47 . . . . 75.22 110.906 179.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 213' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -55.89 114.16 6.99 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.695 0.759 . . . . 73.43 110.913 -179.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -69.72 -17.95 37.49 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.658 2.239 . . . . 63.01 112.372 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 215' ' ' THR . . . . . 0.488 HG23 HG21 ' A' ' 61' ' ' ILE . 0.3 OUTLIER -83.98 60.22 5.72 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.2 -0.454 . . . . 74.24 111.103 -179.935 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.33 0 CA-C-O 120.968 0.413 . . . . 74.14 110.939 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 8.1 t80 . . . . . 0 C--O 1.232 0.162 0 CA-C-O 120.929 0.395 . . . . 65.01 110.861 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.3 -176.87 5.2 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.137 -0.483 . . . . 64.24 110.84 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 226' ' ' LEU . . . . . 0.908 HD23 ' HB3' ' A' ' 115' ' ' MET . 0.7 OUTLIER -59.7 149.12 31.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.204 -0.453 . . . . 53.44 110.97 179.935 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 227' ' ' SER . . . . . 0.411 ' O ' HD12 ' A' ' 231' ' ' ILE . 2.3 t -86.4 160.43 19.06 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.285 -0.416 . . . . 74.21 110.911 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -63.29 -64.94 0.76 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.134 -0.485 . . . . 74.54 110.925 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -55.58 -26.55 44.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.204 -0.453 . . . . 72.22 110.822 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.36 -48.63 60.69 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.314 -0.403 . . . . 74.23 110.865 -179.934 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 231' ' ' ILE . . . . . 0.667 HG23 ' HB3' ' A' ' 119' ' ' GLU . 7.6 mt -69.06 -42.92 82.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.243 -0.435 . . . . 73.41 111.168 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.57 -32.13 73.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.167 -0.47 . . . . 65.42 110.919 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -63.1 -49.0 75.31 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.749 -0.738 . . . . 63.43 112.472 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 234' ' ' ILE . . . . . 0.657 HD12 ' SD ' ' A' ' 202' ' ' MET . 7.3 tt -72.97 -32.45 39.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.759 0.314 . . . . 71.54 111.11 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -70.12 -24.52 63.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.21 -0.45 . . . . 70.33 110.968 179.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 236' ' ' LYS . . . . . 0.431 ' HE2' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.32 -27.58 60.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.169 -0.469 . . . . 51.21 110.879 -179.991 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 237' ' ' LEU . . . . . 0.742 HD22 ' CD ' ' A' ' 83' ' ' LYS . 3.8 tt -97.78 -26.74 14.61 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.241 -0.436 . . . . 75.41 110.907 179.938 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 238' ' ' TYR . . . . . 0.449 ' OH ' HD11 ' A' ' 122' ' ' LEU . 4.4 m-85 -91.96 -35.2 14.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.194 -0.457 . . . . 51.24 110.985 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.293 0 C-N-CA 120.794 -0.717 . . . . 32.22 112.499 179.964 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 50.3 t-105 . . . . . 0 C--O 1.23 0.056 0 CA-C-O 120.796 0.331 . . . . 71.22 110.983 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -58.88 -35.62 73.29 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.202 -0.454 . . . . 72.51 110.884 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.09 -36.64 84.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.185 -0.461 . . . . 61.24 110.857 -179.863 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.1 -42.4 80.69 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.251 -0.432 . . . . 54.34 111.138 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.718 ' NE2' HD12 ' A' ' 35' ' ' LEU . 0.0 OUTLIER -73.07 -43.03 62.41 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.187 -0.46 . . . . 73.12 110.927 -179.926 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -61.63 -32.44 72.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.243 -0.435 . . . . 72.4 110.938 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 8.5 m-85 -70.38 -37.07 74.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.15 -0.477 . . . . 75.11 110.953 -179.853 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.617 HD13 ' O ' ' A' ' 19' ' ' LEU . 3.0 tm? -71.73 -24.54 61.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.108 -0.496 . . . . 72.51 110.869 179.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.441 ' HE2' ' HA ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -72.23 -42.36 65.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.238 -0.437 . . . . 74.41 110.918 179.801 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.441 ' HA ' ' HE2' ' A' ' 20' ' ' LYS . 3.2 ptm180 -67.93 -28.19 67.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.19 -0.459 . . . . 74.05 110.887 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.431 ' N ' ' HG3' ' A' ' 21' ' ' ARG . 2.0 m-85 -62.13 -25.09 67.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.199 -0.455 . . . . 74.31 110.86 -179.944 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 . . . . . 0 C--N 1.328 -0.354 0 CA-C-N 116.143 -0.48 . . . . 72.55 110.92 -179.843 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.718 HD12 ' NE2' ' A' ' 16' ' ' GLN . 0.8 OUTLIER . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.803 0.335 . . . . 72.52 110.921 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.473 ' N ' HD23 ' A' ' 35' ' ' LEU . 0.4 OUTLIER -63.63 -53.12 56.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.195 -0.457 . . . . 73.13 110.843 179.944 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -59.35 -49.32 78.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.156 -0.475 . . . . 63.32 111.071 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.556 ' HD3' HD12 ' A' ' 19' ' ' LEU . 33.7 tttt -59.91 -38.79 83.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.225 -0.443 . . . . 72.32 110.92 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.461 HD22 ' HG ' ' A' ' 35' ' ' LEU . 0.8 OUTLIER -67.53 -35.93 80.04 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.267 -0.424 . . . . 72.11 110.931 179.888 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 19.3 mttt -63.14 -45.17 93.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.123 -0.489 . . . . 62.43 110.951 179.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -69.48 -33.32 72.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.191 -0.458 . . . . 75.11 110.903 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.563 ' CE ' HD11 ' A' ' 61' ' ' ILE . 1.9 ttt -66.06 -47.66 73.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.137 -0.483 . . . . 63.43 110.922 179.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.693 ' HA ' HD12 ' A' ' 48' ' ' LEU . 17.4 mt-30 -58.64 -39.65 81.18 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.223 -0.444 . . . . 74.45 110.896 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.8 mmpt? -59.23 -20.57 55.19 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.248 -0.433 . . . . 71.43 110.823 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 68.8 t80 -70.42 -46.3 64.2 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.274 -0.421 . . . . 73.32 110.817 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.625 ' CE1' HD12 ' A' ' 61' ' ' ILE . 36.1 m-85 -81.82 -3.78 54.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.175 -0.466 . . . . 70.43 110.888 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.45 12.49 84.49 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.689 -0.767 . . . . 64.34 112.475 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.693 HD12 ' HA ' ' A' ' 43' ' ' GLN . 0.3 OUTLIER -59.73 140.58 89.45 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.568 0.699 . . . . 64.11 110.941 -179.936 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.8 -53.29 0.28 Allowed 'Trans proline' 0 C--O 1.231 0.159 0 C-N-CA 122.72 2.28 . . . . 74.5 112.318 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.545 HD11 ' HB3' ' A' ' 48' ' ' LEU . 0.8 OUTLIER -53.33 139.25 11.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 71.22 111.032 179.969 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -129.63 126.94 39.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.133 -0.485 . . . . 73.25 111.174 179.877 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 85.07 5.69 85.62 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.735 -0.745 . . . . 64.24 112.509 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -135.05 154.63 51.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.829 0.347 . . . . 75.23 110.864 -179.942 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.428 HD23 ' CD2' ' A' ' 39' ' ' LEU . 2.8 pp -159.16 130.23 6.11 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.203 -0.453 . . . . 73.4 110.955 179.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 173.96 -24.38 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.132 -0.486 . . . . 44.35 110.898 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -104.09 -81.27 0.52 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 75.25 110.912 -179.888 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.672 ' O ' HG23 ' A' ' 61' ' ' ILE . 0.1 OUTLIER -84.3 -45.55 12.71 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.161 -0.472 . . . . 61.22 110.954 179.974 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.525 HG22 HD13 ' A' ' 48' ' ' LEU . 41.3 t -57.14 -45.69 84.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.124 -0.489 . . . . 70.12 111.129 179.94 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.423 HD13 ' HB2' ' A' ' 62' ' ' MET . 0.2 OUTLIER -74.63 -30.45 25.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.163 -0.472 . . . . 74.43 111.105 179.989 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -59.62 -40.47 87.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.174 -0.466 . . . . 73.45 110.832 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.672 HG23 ' O ' ' A' ' 57' ' ' ARG . 0.5 OUTLIER -68.43 -29.43 44.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.156 -0.474 . . . . 74.52 111.115 -179.968 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . 0.423 ' HB2' HD13 ' A' ' 59' ' ' ILE . 6.9 mtt -65.19 -32.68 74.48 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.161 -0.472 . . . . 74.01 110.932 179.775 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -100.66 -26.48 13.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.16 -0.473 . . . . 42.22 110.913 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.35 119.01 71.89 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.52 0.676 . . . . 65.34 110.932 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.71 143.36 50.83 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.706 2.271 . . . . 72.11 112.33 179.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 2.0 ppt_? -155.73 -53.73 0.09 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.192 -0.458 . . . . 71.51 110.882 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 6.4 t -139.42 123.88 18.23 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.163 -0.471 . . . . 55.3 110.928 -179.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.534 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -79.33 -36.91 25.81 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.747 -0.739 . . . . 64.23 112.462 -179.888 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.673 HG21 ' O ' ' A' ' 159' ' ' ALA . 1.1 t -64.71 146.45 98.45 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-O 121.592 0.71 . . . . 74.23 111.209 -179.988 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . 0.515 ' HD2' HG22 ' A' ' 69' ' ' VAL . 52.9 Cg_endo -69.81 159.85 51.84 Favored 'Trans proline' 0 C--O 1.231 0.166 0 C-N-CA 122.675 2.25 . . . . 63.44 112.302 -180.0 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -85.0 -0.29 53.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.219 -0.446 . . . . 74.45 110.876 179.925 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.9 m . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.199 -0.455 . . . . 53.43 111.095 -179.954 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo . . . . . 0 C--O 1.232 0.195 0 CA-C-O 120.865 0.277 . . . . 71.11 112.316 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.764 ' HD2' HD13 ' A' ' 237' ' ' LEU . 4.2 mtpt -88.98 150.72 22.68 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.229 -0.441 . . . . 64.45 110.906 179.928 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . 0.414 ' CH2' ' HB3' ' A' ' 162' ' ' PRO . 95.6 m95 -50.96 132.54 27.24 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.324 -0.398 . . . . 73.31 110.935 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -114.48 -10.66 12.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.307 -0.406 . . . . 65.3 111.147 -179.916 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -64.85 -176.77 0.29 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.241 -0.436 . . . . 70.34 110.909 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 9.7 mptt -99.39 -11.14 21.43 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.116 -0.493 . . . . 71.12 110.885 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.459 HG23 ' CD2' ' A' ' 123' ' ' HIS . 0.4 OUTLIER -156.19 142.1 10.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.172 -0.467 . . . . 74.14 111.141 179.877 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 90.5 t -118.46 130.51 73.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.101 -0.499 . . . . 72.25 111.156 179.865 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -115.95 161.57 18.64 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.202 -0.453 . . . . 71.01 111.128 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 4.6 p90 -149.37 147.16 27.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 70.51 110.88 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -150.07 138.86 20.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.103 -0.498 . . . . 71.25 110.96 -179.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.441 HD11 ' HA ' ' A' ' 106' ' ' ASP . 10.0 mm -78.29 133.48 30.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.24 -0.436 . . . . 72.4 111.169 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.485 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 18.8 t -86.91 -40.47 14.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.194 -0.457 . . . . 60.2 111.201 179.825 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 2.9 t -143.67 169.38 17.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.128 -0.487 . . . . 64.24 110.859 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 8.8 p90 -111.62 148.88 32.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.165 -0.47 . . . . 72.25 110.926 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.51 ' OG1' HG21 ' A' ' 105' ' ' VAL . 0.2 OUTLIER -82.91 141.05 32.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.071 -0.513 . . . . 64.11 111.134 -179.986 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 2.8 ppt_? -71.7 -8.76 56.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.209 -0.45 . . . . 72.14 110.799 -179.925 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -96.6 -25.79 15.47 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.199 -0.455 . . . . 74.13 110.876 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.468 ' O ' ' O ' ' A' ' 97' ' ' THR . 1.1 mp -137.68 152.45 72.68 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.618 0.723 . . . . 72.52 110.927 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . 0.599 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.9 Cg_endo -69.73 150.95 69.1 Favored 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 122.701 2.268 . . . . 73.11 112.309 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 4.7 t-160 -52.06 -25.59 9.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.455 . . . . 74.11 110.837 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.599 HG22 ' HB2' ' A' ' 101' ' ' PRO . 11.7 tt -77.26 -37.47 25.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.263 -0.426 . . . . 74.02 111.143 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . 0.795 ' O ' HD22 ' A' ' 108' ' ' LEU . 3.4 m -68.94 -39.19 79.71 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.174 -0.467 . . . . 52.11 111.13 179.941 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.792 ' O ' HG13 ' A' ' 109' ' ' VAL . 81.1 t -71.76 -45.74 64.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.212 -0.449 . . . . 71.51 111.145 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.624 ' O ' HG22 ' A' ' 109' ' ' VAL . 16.0 t0 -62.61 -39.53 94.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.208 -0.451 . . . . 63.44 110.917 179.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . 0.499 ' HG3' ' N ' ' A' ' 108' ' ' LEU . 0.0 OUTLIER -70.57 -33.8 71.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.168 -0.469 . . . . 75.02 110.926 179.996 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.795 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -65.61 -49.56 68.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.202 -0.453 . . . . 71.04 110.934 -179.971 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.792 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.6 m -55.83 -42.93 72.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.183 -0.462 . . . . 72.31 111.059 179.877 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.489 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 44.6 t -70.2 -34.17 72.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.13 -0.487 . . . . 72.14 110.903 -179.824 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.496 ' CG ' HD21 ' A' ' 189' ' ' LEU . 0.4 OUTLIER -62.16 -33.25 74.16 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.105 -0.498 . . . . 74.35 110.942 179.878 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.43 -40.28 9.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.272 -0.422 . . . . 74.32 111.16 179.755 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.852 HD12 HD12 ' A' ' 196' ' ' LEU . 0.4 OUTLIER -65.59 -33.2 75.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 72.0 110.949 179.97 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -69.59 -44.42 70.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.15 -0.477 . . . . 72.34 110.87 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . 0.492 ' O ' HD11 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -57.84 -34.86 70.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.207 -0.452 . . . . 54.12 110.843 179.936 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 5.1 m95 -62.53 -47.44 83.91 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.287 -0.415 . . . . 75.23 110.91 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' GLY . . . . . 0.482 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -72.97 -32.77 60.41 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.745 -0.741 . . . . 73.32 112.507 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.0 mmpt? -62.98 -14.3 45.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.842 0.353 . . . . 72.42 110.971 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.734 ' HG2' HD13 ' A' ' 226' ' ' LEU . 0.9 OUTLIER -104.65 13.71 31.07 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.112 -0.495 . . . . 75.24 110.906 179.904 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 1.063 HD12 HD12 ' A' ' 122' ' ' LEU . 5.8 pt -146.91 156.29 47.61 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.707 0.765 . . . . 71.34 111.063 -179.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.83 2.14 3.84 Favored 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 122.701 2.267 . . . . 72.21 112.333 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 1.063 HD12 HD12 ' A' ' 120' ' ' ILE . 7.1 mt -60.96 -157.42 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.219 -0.446 . . . . 73.22 110.892 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.459 ' CD2' HG23 ' A' ' 88' ' ' VAL . 5.0 t60 -163.63 138.47 6.15 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.158 -0.474 . . . . 74.12 110.822 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . 0.469 ' CD2' HD21 ' A' ' 113' ' ' LEU . 37.3 m-85 -120.88 148.83 43.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.195 -0.457 . . . . 75.54 110.902 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.4 141.22 51.48 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.204 -0.453 . . . . 75.14 110.877 -179.879 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.51 140.04 36.07 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.219 -0.446 . . . . 72.22 110.84 179.973 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . 0.933 HG11 ' HB2' ' A' ' 132' ' ' ALA . 15.0 m -102.56 131.48 50.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.188 -0.46 . . . . 50.13 111.149 179.871 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.462 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -143.93 -22.33 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 74.43 111.122 179.962 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' TRP . . . . . 0.462 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -138.6 109.19 6.58 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.151 -0.477 . . . . 71.25 110.91 179.992 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.67 -159.59 14.4 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.655 -0.783 . . . . 62.11 112.49 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.87 155.71 17.98 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.788 0.327 . . . . 63.25 111.115 -179.86 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . 0.933 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -112.08 165.19 12.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.209 -0.45 . . . . 51.34 111.128 179.824 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -65.89 -62.61 1.4 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.23 -0.441 . . . . 75.41 110.888 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 53.6 mt -86.59 132.25 32.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.21 -0.45 . . . . 70.51 111.142 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . 0.485 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 18.4 mmm -110.64 123.1 49.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.214 -0.448 . . . . 72.43 110.892 179.846 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.44 ' O ' HG23 ' A' ' 93' ' ' ILE . 0.5 OUTLIER -106.54 92.87 2.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.256 -0.429 . . . . 70.04 111.133 179.983 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . 0.453 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -135.56 162.58 24.91 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.783 -0.722 . . . . 63.34 112.491 179.911 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -105.25 142.53 34.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.856 0.36 . . . . 74.01 110.918 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.486 ' HB1' ' HB3' ' A' ' 143' ' ' HIS . . . 179.74 168.02 1.18 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.199 -0.455 . . . . 71.21 111.107 179.891 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 38.3 mtm180 -103.29 173.43 6.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.226 -0.443 . . . . 62.21 110.899 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -52.8 -19.06 6.31 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.755 -0.736 . . . . 74.24 112.495 -179.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -87.89 13.36 10.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.857 0.36 . . . . 75.03 111.127 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 143' ' ' HIS . . . . . 0.486 ' HB3' ' HB1' ' A' ' 139' ' ' ALA . 11.0 p80 -77.05 -22.02 53.59 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.17 -0.468 . . . . 71.11 110.823 -179.924 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 138.18 52.67 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.798 -0.715 . . . . 45.51 112.509 -179.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 34.4 p-10 -173.36 156.59 3.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.885 0.374 . . . . 72.14 110.815 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 9.7 m -71.69 173.48 8.07 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.124 -0.489 . . . . 51.25 110.859 -179.781 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 147' ' ' TYR . . . . . 0.434 ' HA ' ' HD2' ' A' ' 148' ' ' PRO . 0.1 OUTLIER 63.1 106.82 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.571 0.7 . . . . 73.4 110.902 -179.887 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 148' ' ' PRO . . . . . 0.434 ' HD2' ' HA ' ' A' ' 147' ' ' TYR . 54.4 Cg_endo -69.71 143.54 51.41 Favored 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.717 2.278 . . . . 74.53 112.353 179.887 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 149' ' ' PHE . . . . . 0.454 ' CE1' ' HB2' ' A' ' 173' ' ' ASP . 0.1 OUTLIER -64.2 -14.7 57.03 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.247 -0.433 . . . . 63.52 110.931 179.943 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 75.6 -4.11 2.44 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.127 -0.488 . . . . 63.11 110.85 179.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 66.92 -137.96 34.48 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.711 -0.757 . . . . 71.41 112.515 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.72 141.33 45.08 Favored 'Trans proline' 0 C--O 1.231 0.144 0 C-N-CA 122.699 2.266 . . . . 75.11 112.37 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 103.4 -144.9 16.07 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.778 -0.725 . . . . 70.32 112.456 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -39.01 150.19 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.967 0.413 . . . . 73.25 110.88 -179.834 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 155' ' ' THR . . . . . 0.409 ' CG2' ' HA2' ' A' ' 68' ' ' GLY . 0.2 OUTLIER 75.24 103.71 0.07 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.163 -0.471 . . . . 44.41 111.129 -179.956 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 156' ' ' LEU . . . . . 1.009 HD21 HG21 ' A' ' 186' ' ' ILE . 0.5 OUTLIER -87.08 -54.98 4.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.224 -0.444 . . . . 75.02 110.96 179.911 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . 0.557 ' HB1' ' O ' ' A' ' 171' ' ' HIS . . . -162.11 148.47 13.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.471 . . . . 71.42 111.045 179.76 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 32.0 p-80 -112.28 118.74 36.11 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.143 -0.48 . . . . 72.02 110.821 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . 0.673 ' O ' HG21 ' A' ' 69' ' ' VAL . . . -111.16 150.18 29.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 74.42 111.098 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -120.65 172.83 7.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.183 -0.462 . . . . 75.31 110.904 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 161' ' ' ALA . . . . . 0.695 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -104.12 164.26 15.67 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.591 0.71 . . . . 61.04 111.133 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 162' ' ' PRO . . . . . 0.695 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.3 Cg_endo -69.8 88.49 0.54 Allowed 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.68 2.254 . . . . 74.44 112.38 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -124.27 120.44 4.07 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.798 -0.715 . . . . 61.41 112.53 179.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 2.3 m 73.41 -68.33 0.23 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.823 0.344 . . . . 73.1 111.175 -179.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . 176.46 -61.67 0.1 Allowed Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.714 -0.755 . . . . 74.03 112.442 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 166' ' ' LEU . . . . . 0.541 HD23 ' O ' ' A' ' 166' ' ' LEU . 9.7 tt -53.95 -30.99 49.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.854 0.359 . . . . 65.12 110.897 -179.89 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -72.43 -173.87 22.97 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.765 -0.731 . . . . 43.43 112.465 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 73.01 22.93 78.75 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.69 -0.767 . . . . 74.31 112.498 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -100.44 161.6 13.49 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.859 0.362 . . . . 63.41 110.882 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.56 130.76 55.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.204 -0.453 . . . . 74.21 111.024 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 171' ' ' HIS . . . . . 0.557 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 48.3 m170 -127.0 132.74 50.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.181 -0.463 . . . . 72.53 110.862 -180.0 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 38.0 m-85 -116.13 138.86 50.88 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.238 -0.437 . . . . 71.44 110.883 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 173' ' ' ASP . . . . . 0.454 ' HB2' ' CE1' ' A' ' 149' ' ' PHE . 11.1 t0 -64.92 95.19 0.15 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 74.11 110.858 179.983 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 2.9 pp20? -55.64 -18.7 8.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.23 -0.441 . . . . 72.25 110.904 -179.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.82 -22.73 42.68 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.177 -0.465 . . . . 73.32 110.884 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 176' ' ' GLU . . . . . 0.438 ' HG3' HD13 ' A' ' 156' ' ' LEU . 0.0 OUTLIER -72.73 -170.99 0.76 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 63.2 110.89 -179.926 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 177' ' ' ARG . . . . . 0.409 ' HG3' ' HA3' ' A' ' 185' ' ' GLY . 0.5 OUTLIER -116.57 114.37 24.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.166 -0.47 . . . . 63.14 110.909 -179.88 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 48.6 m95 -116.77 142.77 46.49 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.173 -0.467 . . . . 72.31 111.014 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 179' ' ' THR . . . . . 0.511 HG21 ' HB3' ' A' ' 182' ' ' SER . 13.1 t -177.66 163.57 1.91 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.279 -0.419 . . . . 74.13 111.183 -179.942 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -125.0 -68.86 0.82 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.22 -0.445 . . . . 45.33 110.913 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -63.6 -13.13 49.79 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.736 -0.745 . . . . 62.41 112.555 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 182' ' ' SER . . . . . 0.511 ' HB3' HG21 ' A' ' 179' ' ' THR . 0.3 OUTLIER -93.48 -24.39 18.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.917 0.389 . . . . 64.5 110.877 -179.8 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 183' ' ' SER . . . . . 0.402 ' C ' ' O ' ' A' ' 182' ' ' SER . 7.4 p 37.97 43.78 0.56 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.091 -0.504 . . . . 64.12 110.854 -179.809 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 1.2 tt -107.51 -33.39 7.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.104 -0.498 . . . . 74.2 110.91 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 185' ' ' GLY . . . . . 0.409 ' HA3' ' HG3' ' A' ' 177' ' ' ARG . . . -113.42 -145.58 9.3 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.736 -0.745 . . . . 73.01 112.485 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 186' ' ' ILE . . . . . 1.009 HG21 HD21 ' A' ' 156' ' ' LEU . 8.2 mm -79.03 99.54 3.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.893 0.377 . . . . 73.22 111.125 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -44.27 123.85 3.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.466 . . . . 71.31 110.873 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 188' ' ' PHE . . . . . 0.702 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.4 t80 -59.83 -38.45 82.06 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.098 -0.501 . . . . 75.45 110.872 -179.92 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . 0.496 HD21 ' CG ' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -67.34 -47.61 69.97 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.129 -0.487 . . . . 52.02 110.895 179.984 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 65.6 t80 -67.54 -39.86 84.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.248 -0.433 . . . . 74.22 110.931 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 191' ' ' ALA . . . . . 0.566 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -72.5 -35.21 68.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.091 -0.504 . . . . 50.03 111.121 179.903 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 192' ' ' ALA . . . . . 0.686 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -57.37 -44.69 84.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 52.11 111.079 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 193' ' ' THR . . . . . 0.403 HG21 HG21 ' A' ' 211' ' ' VAL . 13.6 m -58.28 -43.41 88.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.225 -0.443 . . . . 72.43 111.137 -179.911 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 34.1 t60 -72.82 -42.97 63.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.2 -0.455 . . . . 71.44 110.863 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -69.87 -47.72 61.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.221 -0.445 . . . . 71.01 111.106 179.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 196' ' ' LEU . . . . . 0.852 HD12 HD12 ' A' ' 113' ' ' LEU . 4.5 mm? -64.62 -33.58 76.28 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.217 -0.447 . . . . 74.51 110.865 -179.942 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -63.58 -26.55 69.85 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.701 -0.761 . . . . 52.23 112.475 179.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 198' ' ' HIS . . . . . . . . . . . . . 4.3 m-70 -67.07 -42.66 84.31 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.825 0.345 . . . . 75.21 110.813 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . 0.416 ' O ' ' HD3' ' A' ' 162' ' ' PRO . 0.1 OUTLIER -61.85 -20.53 63.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.225 -0.443 . . . . 71.13 110.865 -179.755 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 200' ' ' LEU . . . . . 0.423 ' N ' HD23 ' A' ' 200' ' ' LEU . 1.7 mt -86.37 3.2 44.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.091 -0.504 . . . . 64.13 110.872 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 84.1 -9.35 63.79 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.714 -0.755 . . . . 50.41 112.466 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 202' ' ' MET . . . . . . . . . . . . . 42.1 tpp -54.72 153.93 5.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.847 0.356 . . . . 63.21 110.914 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -117.68 177.97 16.79 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.699 -0.762 . . . . 64.44 112.467 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 204' ' ' HIS . . . . . 0.414 ' HA ' ' HB3' ' A' ' 212' ' ' MET . 45.6 m-70 -77.92 149.97 34.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.799 0.333 . . . . 74.32 110.833 -179.955 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 66.2 m -121.86 149.91 42.69 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.18 -0.463 . . . . 53.34 110.835 -179.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 79.1 p -87.79 -4.37 58.88 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.126 -0.488 . . . . 72.22 110.849 -179.796 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 207' ' ' ASP . . . . . 0.42 ' HB2' ' HB2' ' A' ' 210' ' ' ALA . 8.4 m-20 -71.62 130.45 87.23 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.614 0.721 . . . . 65.11 110.858 179.974 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.72 -8.28 23.19 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.688 2.258 . . . . 74.53 112.351 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -116.26 11.09 15.0 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.145 -0.48 . . . . 63.52 110.915 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 210' ' ' ALA . . . . . 0.484 ' HB1' ' CE ' ' A' ' 212' ' ' MET . . . -87.18 146.02 26.18 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.132 -0.486 . . . . 62.23 111.088 179.838 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 211' ' ' VAL . . . . . 0.431 HG12 ' HG3' ' A' ' 212' ' ' MET . 0.4 OUTLIER -70.47 -25.07 26.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.196 -0.456 . . . . 62.04 111.104 179.902 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 212' ' ' MET . . . . . 0.492 ' HE2' ' HB2' ' A' ' 230' ' ' ASP . 0.4 OUTLIER -86.35 3.19 44.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.199 -0.455 . . . . 75.22 110.901 179.937 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 213' ' ' TYR . . . . . 0.44 ' HB2' ' O ' ' A' ' 210' ' ' ALA . 2.0 t80 -54.85 110.23 2.05 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-O 121.636 0.731 . . . . 73.43 110.887 -179.88 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.77 -18.55 36.89 Favored 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.705 2.27 . . . . 63.01 112.41 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 215' ' ' THR . . . . . 0.402 ' HB ' ' CE2' ' A' ' 213' ' ' TYR . 0.2 OUTLIER -84.27 53.6 2.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.184 -0.462 . . . . 74.24 111.116 -179.959 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 5.6 t80 . . . . . 0 C--N 1.328 -0.351 0 CA-C-N 116.26 -0.427 . . . . 74.14 110.914 -179.93 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.913 0.387 . . . . 65.01 110.841 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.37 147.89 35.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.11 -0.495 . . . . 64.24 110.917 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 226' ' ' LEU . . . . . 0.734 HD13 ' HG2' ' A' ' 119' ' ' GLU . 10.1 mt -75.45 148.92 38.68 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.203 -0.453 . . . . 53.44 110.924 179.973 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 227' ' ' SER . . . . . 0.427 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 2.1 t -87.2 155.3 20.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.241 -0.436 . . . . 74.21 110.84 -179.926 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -64.11 -66.25 0.57 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.099 -0.5 . . . . 74.54 110.957 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -55.69 -25.62 40.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.181 -0.463 . . . . 72.22 110.904 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 230' ' ' ASP . . . . . 0.492 ' HB2' ' HE2' ' A' ' 212' ' ' MET . 1.3 t70 -68.84 -48.45 63.45 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.169 -0.469 . . . . 74.23 110.855 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 231' ' ' ILE . . . . . 0.634 HG23 ' HB3' ' A' ' 119' ' ' GLU . 12.0 mt -68.21 -42.26 84.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.231 -0.44 . . . . 73.41 111.067 180.0 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 15.2 pttm -65.9 -32.14 73.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.199 -0.455 . . . . 65.42 110.929 179.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -62.62 -46.63 93.34 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.756 -0.735 . . . . 63.43 112.472 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 12.2 tt -72.93 -30.54 32.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.779 0.323 . . . . 71.54 111.101 -179.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -70.96 -24.71 62.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.174 -0.466 . . . . 70.33 110.879 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 236' ' ' LYS . . . . . 0.428 ' HE2' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.1 -26.82 60.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.218 -0.446 . . . . 51.21 110.903 179.969 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 237' ' ' LEU . . . . . 0.764 HD13 ' HD2' ' A' ' 83' ' ' LYS . 10.3 tt -97.25 -24.54 15.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.224 -0.443 . . . . 75.41 110.937 179.878 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 238' ' ' TYR . . . . . 0.625 ' CZ ' HD11 ' A' ' 122' ' ' LEU . 6.3 m-85 -92.36 -35.07 13.92 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.228 -0.442 . . . . 51.24 110.913 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.28 0 C-N-CA 120.791 -0.718 . . . . 32.22 112.524 179.988 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 11.6 t-105 . . . . . 0 C--O 1.23 0.049 0 CA-C-O 120.764 0.316 . . . . 71.22 110.954 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -73.28 -35.37 66.15 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.217 -0.447 . . . . 72.51 110.861 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -62.96 -36.92 85.06 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.229 -0.441 . . . . 61.24 110.92 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.632 ' CB ' HD21 ' A' ' 54' ' ' LEU . . . -59.16 -41.2 87.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 54.34 111.078 179.889 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -72.92 -42.99 62.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.245 -0.434 . . . . 73.12 110.911 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -65.86 -31.82 72.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.219 -0.446 . . . . 72.4 110.847 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -70.33 -35.86 73.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.172 -0.467 . . . . 75.11 110.85 -179.725 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.682 HD13 ' HG2' ' A' ' 38' ' ' LYS . 1.9 mt -71.06 -21.03 62.3 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.157 -0.474 . . . . 72.51 110.952 179.925 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.0 ptmt -75.35 -29.88 60.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.128 -0.487 . . . . 74.41 110.856 179.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.7 ptp180 -86.2 -27.22 24.65 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.259 -0.428 . . . . 74.05 110.839 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -59.62 -21.24 60.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.207 -0.451 . . . . 74.31 110.885 -179.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.439 ' CE2' HD22 ' A' ' 19' ' ' LEU . 5.8 m-85 . . . . . 0 C--N 1.328 -0.363 0 CA-C-N 116.164 -0.471 . . . . 72.55 110.939 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.437 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 8.6 tt . . . . . 0 C--O 1.23 0.056 0 CA-C-O 120.74 0.305 . . . . 72.52 110.885 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.44 -51.25 70.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.204 -0.453 . . . . 73.13 110.894 179.918 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -66.04 -36.6 83.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.171 -0.468 . . . . 63.32 111.126 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.682 ' HG2' HD13 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -65.59 -49.08 70.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.447 . . . . 72.32 110.912 179.934 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.439 ' CD2' HD12 ' A' ' 19' ' ' LEU . 4.6 mt -63.19 -35.38 80.11 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.156 -0.475 . . . . 72.11 110.914 179.924 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.8 tttt -68.48 -45.73 71.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.249 -0.432 . . . . 62.43 110.876 179.83 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.547 ' HG3' ' N ' ' A' ' 42' ' ' MET . 0.0 OUTLIER -59.93 -31.87 70.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.193 -0.458 . . . . 75.11 110.946 179.949 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.726 ' CE ' HD11 ' A' ' 61' ' ' ILE . 38.2 ttp -68.5 -34.09 75.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.142 -0.481 . . . . 63.43 110.901 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.458 ' OE1' HD11 ' A' ' 48' ' ' LEU . 1.2 mm-40 -60.65 -39.44 88.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.209 -0.45 . . . . 74.45 110.92 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.1 mmpt? -68.37 -28.36 67.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.47 . . . . 71.43 110.874 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 28.1 t80 -70.28 -45.01 67.2 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.18 -0.464 . . . . 73.32 110.86 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.588 ' CZ ' HD12 ' A' ' 61' ' ' ILE . 17.2 m-85 -81.98 -35.12 29.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.174 -0.466 . . . . 70.43 110.913 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 102.73 -7.13 52.9 Favored Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.75 -0.738 . . . . 64.34 112.466 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.474 HD23 ' CB ' ' A' ' 46' ' ' PHE . 0.8 OUTLIER -59.82 138.78 90.33 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.565 0.697 . . . . 64.11 110.968 -179.975 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.519 ' O ' HG23 ' A' ' 51' ' ' THR . 53.9 Cg_endo -69.73 -53.01 0.29 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.651 2.234 . . . . 74.5 112.374 179.886 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.664 HD12 HG23 ' A' ' 58' ' ' VAL . 0.9 OUTLIER -51.32 108.22 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.215 -0.448 . . . . 71.22 111.126 179.881 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.519 HG23 ' O ' ' A' ' 49' ' ' PRO . 41.4 p -109.0 164.37 12.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.178 -0.464 . . . . 73.25 111.118 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 59.56 17.65 41.62 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.723 -0.751 . . . . 64.24 112.475 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -114.57 161.05 18.56 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.857 0.361 . . . . 75.23 110.837 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.632 HD21 ' CB ' ' A' ' 15' ' ' ALA . 26.8 tp -168.56 84.99 0.17 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.206 -0.452 . . . . 73.4 110.903 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.418 ' HA ' HG13 ' A' ' 59' ' ' ILE . 3.4 p30 175.55 -29.24 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.148 -0.478 . . . . 44.35 110.91 179.914 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 28.5 t -90.84 -100.52 0.1 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.156 -0.474 . . . . 75.25 110.902 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.587 ' O ' HG23 ' A' ' 61' ' ' ILE . 10.7 tpt180 -85.05 -28.89 25.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.155 -0.475 . . . . 61.22 110.884 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.664 HG23 HD12 ' A' ' 50' ' ' ILE . 66.6 t -64.98 -41.56 92.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.188 -0.46 . . . . 70.12 111.103 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.425 HD11 ' HB2' ' A' ' 15' ' ' ALA . 1.0 OUTLIER -74.59 -31.45 27.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.206 -0.452 . . . . 74.43 111.164 179.895 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.03 -33.09 70.34 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.121 -0.49 . . . . 73.45 110.91 179.925 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.726 HD11 ' CE ' ' A' ' 42' ' ' MET . 0.4 OUTLIER -76.45 -29.56 18.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.125 -0.489 . . . . 74.52 111.093 -179.975 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . 0.417 ' HE3' ' HB1' ' A' ' 15' ' ' ALA . 5.2 mmt -64.41 -37.35 87.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.144 -0.48 . . . . 74.01 110.88 179.891 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -86.58 -23.29 25.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.26 -0.427 . . . . 42.22 110.918 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -85.08 124.97 71.58 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.588 0.709 . . . . 65.34 110.842 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 160.49 49.51 Favored 'Trans proline' 0 C--O 1.233 0.254 0 C-N-CA 122.683 2.255 . . . . 72.11 112.406 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -155.53 -77.46 0.1 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.31 -0.405 . . . . 71.51 110.914 -179.957 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -145.18 155.18 43.13 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.119 -0.491 . . . . 55.3 110.843 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.561 ' HA2' HG23 ' A' ' 155' ' ' THR . . . -97.53 11.81 64.86 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.727 -0.749 . . . . 64.23 112.534 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.652 HG21 ' CD2' ' A' ' 198' ' ' HIS . 0.9 OUTLIER -92.37 136.47 25.51 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.703 0.763 . . . . 74.23 111.139 -179.958 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . 0.507 ' HD2' HG12 ' A' ' 69' ' ' VAL . 54.1 Cg_endo -69.75 155.1 66.87 Favored 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.691 2.26 . . . . 63.44 112.338 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -92.66 15.49 14.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.224 -0.444 . . . . 74.45 110.88 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.183 -0.462 . . . . 53.43 111.108 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo . . . . . 0 N--CA 1.465 -0.151 0 CA-C-O 120.898 0.291 . . . . 71.11 112.378 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.748 ' HD2' HD22 ' A' ' 237' ' ' LEU . 2.6 mttm -84.08 161.74 20.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.157 -0.474 . . . . 64.45 110.895 179.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . 0.751 ' CE3' HG21 ' A' ' 89' ' ' VAL . 40.6 m0 -49.63 123.48 7.87 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.158 -0.474 . . . . 73.31 110.983 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 9.9 t -115.19 -19.43 10.82 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.241 -0.436 . . . . 65.3 111.128 -179.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -53.46 160.98 1.08 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.216 -0.447 . . . . 70.34 110.832 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 2.8 ptmt -74.03 -30.61 62.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.064 -0.516 . . . . 71.12 110.892 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.54 HG23 ' CD2' ' A' ' 123' ' ' HIS . 0.7 OUTLIER -152.72 144.54 15.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.235 -0.439 . . . . 74.14 111.105 179.938 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.751 HG21 ' CE3' ' A' ' 84' ' ' TRP . 12.2 t -130.77 140.95 47.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.22 -0.445 . . . . 72.25 111.101 179.852 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.764 HG22 ' HB3' ' A' ' 125' ' ' ARG . 11.0 p -117.18 167.94 10.74 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.088 -0.505 . . . . 71.01 111.128 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.435 ' HB3' ' HB ' ' A' ' 134' ' ' ILE . 4.9 p90 -150.35 146.55 26.8 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.198 -0.456 . . . . 70.51 110.961 -179.856 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 4.5 ttt-85 -146.29 136.24 23.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.165 -0.471 . . . . 71.25 110.854 -179.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.447 HD11 ' HA ' ' A' ' 106' ' ' ASP . 3.4 mp -74.76 135.54 27.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.169 -0.469 . . . . 72.4 111.195 179.903 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.405 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 19.3 t -89.15 -40.7 13.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.2 -0.454 . . . . 60.2 111.112 179.914 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 5.6 t -144.56 163.4 34.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.208 -0.451 . . . . 64.24 110.857 -179.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 11.2 p90 -110.58 152.47 26.39 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.138 -0.483 . . . . 72.25 110.921 -179.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.474 ' OG1' HG21 ' A' ' 105' ' ' VAL . 0.2 OUTLIER -82.68 140.99 32.8 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.117 -0.492 . . . . 64.11 111.173 -179.989 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.92 -7.8 52.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.197 -0.456 . . . . 72.14 110.923 179.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -96.42 -26.1 15.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.251 -0.431 . . . . 74.13 110.889 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.508 HD11 ' HA ' ' A' ' 179' ' ' THR . 0.9 OUTLIER -133.54 153.6 80.38 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.591 0.71 . . . . 72.52 111.006 -179.956 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . 0.569 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.9 Cg_endo -69.71 150.89 69.13 Favored 'Trans proline' 0 C--O 1.231 0.159 0 C-N-CA 122.703 2.269 . . . . 73.11 112.365 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 15.9 t-160 -52.74 -27.38 17.46 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.221 -0.445 . . . . 74.11 110.866 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.569 HG22 ' HB2' ' A' ' 101' ' ' PRO . 0.0 OUTLIER -75.72 -39.43 39.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.18 -0.463 . . . . 74.02 111.109 -179.956 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . 0.681 ' O ' HD22 ' A' ' 108' ' ' LEU . 3.1 m -69.33 -39.13 78.37 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.114 -0.493 . . . . 52.11 111.154 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.689 ' O ' HG13 ' A' ' 109' ' ' VAL . 92.0 t -72.61 -44.83 60.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.224 -0.444 . . . . 71.51 111.119 179.904 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.635 ' O ' HG22 ' A' ' 109' ' ' VAL . 3.9 t0 -66.25 -41.91 89.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.215 -0.448 . . . . 63.44 110.841 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 6.6 ptm180 -69.9 -33.8 72.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 75.02 110.829 -179.839 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.681 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -60.73 -48.95 79.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.196 -0.456 . . . . 71.04 110.882 -179.96 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.689 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.3 m -55.61 -41.96 66.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.181 -0.463 . . . . 72.31 111.112 179.893 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.469 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 42.7 t -69.97 -34.1 72.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.142 -0.481 . . . . 72.14 110.874 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.453 ' CG ' HD21 ' A' ' 189' ' ' LEU . 0.4 OUTLIER -62.46 -33.33 74.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.111 -0.495 . . . . 74.35 110.882 179.964 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -94.02 -40.97 9.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.288 -0.415 . . . . 74.32 111.12 179.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.75 ' CD1' HD12 ' A' ' 196' ' ' LEU . 0.5 OUTLIER -65.47 -32.91 74.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.179 -0.464 . . . . 72.0 110.969 179.937 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -67.9 -38.06 82.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.226 -0.443 . . . . 72.34 110.946 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . 0.657 ' O ' HD11 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -62.41 -34.62 77.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.083 -0.508 . . . . 54.12 110.881 179.871 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' TRP . . . . . 0.41 ' CZ3' ' SD ' ' A' ' 202' ' ' MET . 8.4 m95 -65.98 -52.29 50.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.198 -0.455 . . . . 75.23 110.929 -179.968 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -63.94 -37.22 94.31 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.728 -0.749 . . . . 73.32 112.453 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.41 -16.31 45.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.758 0.313 . . . . 72.42 110.888 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.65 ' HG3' HG21 ' A' ' 231' ' ' ILE . 0.2 OUTLIER -101.2 12.13 38.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.278 -0.419 . . . . 75.24 110.938 179.938 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 0.879 HD12 HD12 ' A' ' 122' ' ' LEU . 5.1 pt -149.7 149.36 28.07 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.59 0.709 . . . . 71.34 111.113 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.72 25.71 0.17 Allowed 'Trans proline' 0 C--O 1.231 0.166 0 C-N-CA 122.668 2.245 . . . . 72.21 112.354 179.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.879 HD12 HD12 ' A' ' 120' ' ' ILE . 9.9 mt -80.43 -157.53 0.15 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.193 -0.458 . . . . 73.22 110.908 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.54 ' CD2' HG23 ' A' ' 88' ' ' VAL . 4.2 t60 -163.78 133.59 4.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 74.12 110.855 179.868 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 23.4 m-30 -119.59 142.58 48.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.242 -0.436 . . . . 75.54 110.899 -179.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.764 ' HB3' HG22 ' A' ' 90' ' ' THR . 0.1 OUTLIER -118.85 141.92 48.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.157 -0.474 . . . . 75.14 110.916 -179.991 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . 0.506 ' HE3' HG13 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -80.42 149.48 30.13 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.133 -0.485 . . . . 72.22 110.896 179.996 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . 1.024 HG11 ' HB2' ' A' ' 132' ' ' ALA . 27.4 m -103.21 126.5 57.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.267 -0.424 . . . . 50.13 111.086 179.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.587 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -143.55 -11.79 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.237 -0.438 . . . . 74.43 111.18 179.872 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' TRP . . . . . 0.587 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -153.78 109.22 3.2 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.178 -0.464 . . . . 71.25 110.931 179.967 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.59 -161.2 13.69 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.745 -0.74 . . . . 62.11 112.445 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -101.82 155.97 17.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.767 0.317 . . . . 63.25 111.117 -179.818 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . 1.024 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -111.93 165.3 12.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 51.34 111.132 179.84 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -75.9 -62.02 1.73 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.202 -0.454 . . . . 75.41 110.869 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . 0.635 HD12 ' N ' ' A' ' 134' ' ' ILE . 1.3 mp -82.57 107.5 14.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.254 -0.43 . . . . 70.51 111.117 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . 0.405 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 11.1 mmm -92.94 131.78 37.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.221 -0.445 . . . . 72.43 110.876 179.797 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.589 ' CD1' HG22 ' A' ' 134' ' ' ILE . 0.3 OUTLIER -113.34 95.33 3.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.251 -0.432 . . . . 70.04 111.141 179.956 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -136.1 165.51 24.88 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.796 -0.716 . . . . 63.34 112.499 179.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 138' ' ' PHE . . . . . 0.543 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 43.5 m-85 -106.42 149.68 26.79 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.859 0.361 . . . . 74.01 110.861 -179.816 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.543 ' HB2' ' O ' ' A' ' 138' ' ' PHE . . . 170.49 166.42 0.07 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.138 -0.483 . . . . 71.21 111.113 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -104.6 173.53 6.26 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.213 -0.449 . . . . 62.21 110.87 -179.916 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -55.13 -17.45 10.54 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.797 -0.716 . . . . 74.24 112.454 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -87.33 12.97 10.68 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.795 0.331 . . . . 75.03 111.086 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 6.1 p80 -81.44 -4.38 55.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.235 -0.438 . . . . 71.11 110.788 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 124.68 7.31 6.23 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.778 -0.725 . . . . 45.51 112.521 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 29.1 m-20 -111.19 163.64 13.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.856 0.36 . . . . 72.14 110.854 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -87.44 176.89 7.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.173 -0.467 . . . . 51.25 110.854 -179.74 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 66.46 127.98 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.687 0.755 . . . . 73.4 110.933 -179.921 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.87 145.42 56.45 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.677 2.251 . . . . 74.53 112.332 179.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 149' ' ' PHE . . . . . 0.403 ' CE1' ' HB2' ' A' ' 173' ' ' ASP . 0.1 OUTLIER -90.87 -31.61 16.37 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.186 -0.461 . . . . 63.52 110.894 -179.985 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 74.39 -1.67 3.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.145 -0.48 . . . . 63.11 110.855 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 50.04 -108.52 0.5 Allowed Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.721 -0.752 . . . . 71.41 112.48 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -69.71 139.41 40.33 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.707 2.271 . . . . 75.11 112.401 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 103.29 -153.76 18.06 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.712 -0.756 . . . . 70.32 112.484 179.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 154' ' ' ASN . . . . . 0.412 ' O ' ' CB ' ' A' ' 155' ' ' THR . 4.4 p30 -42.77 155.06 0.06 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.904 0.383 . . . . 73.25 110.872 -179.883 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 155' ' ' THR . . . . . 0.561 HG23 ' HA2' ' A' ' 68' ' ' GLY . 0.2 OUTLIER 78.44 114.01 0.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.152 -0.476 . . . . 44.41 111.182 -179.95 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 156' ' ' LEU . . . . . 1.05 HD21 HG21 ' A' ' 186' ' ' ILE . 1.1 tp -101.49 -51.79 3.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.22 -0.446 . . . . 75.02 110.94 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . 0.533 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -159.65 148.46 17.74 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.11 -0.495 . . . . 71.42 111.113 179.812 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 37.0 p-80 -110.32 123.2 49.39 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.215 -0.448 . . . . 72.02 110.868 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . 0.55 ' H ' HG22 ' A' ' 69' ' ' VAL . . . -110.36 160.17 16.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.263 -0.426 . . . . 74.42 111.115 179.944 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 16.6 m-30 -118.91 163.32 17.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.205 -0.452 . . . . 75.31 110.852 -179.894 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 161' ' ' ALA . . . . . 0.725 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -88.09 165.02 31.22 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.543 0.687 . . . . 61.04 111.127 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 162' ' ' PRO . . . . . 0.725 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.6 Cg_endo -69.76 71.61 1.51 Allowed 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.629 2.219 . . . . 74.44 112.377 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -127.91 108.82 0.97 Allowed Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.77 -0.729 . . . . 61.41 112.491 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 1.4 p 59.23 173.74 0.07 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.79 0.329 . . . . 73.1 111.104 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -55.59 -33.74 59.56 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.667 -0.778 . . . . 74.03 112.514 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -71.28 -18.03 62.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.83 0.348 . . . . 65.12 110.89 -179.929 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -88.93 167.29 34.56 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.762 -0.732 . . . . 43.43 112.559 179.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 168' ' ' GLY . . . . . 0.445 ' O ' HG13 ' A' ' 134' ' ' ILE . . . 72.95 15.83 78.36 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.772 -0.728 . . . . 74.31 112.468 -179.893 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -85.76 141.36 29.74 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.823 0.344 . . . . 63.41 110.876 -179.957 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -111.8 130.14 55.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.24 -0.436 . . . . 74.21 111.126 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 171' ' ' HIS . . . . . 0.521 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 49.6 m170 -131.24 132.49 44.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.215 -0.448 . . . . 72.53 110.927 -179.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 31.8 m-85 -111.52 138.02 48.59 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.208 -0.451 . . . . 71.44 110.859 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 173' ' ' ASP . . . . . 0.403 ' HB2' ' CE1' ' A' ' 149' ' ' PHE . 65.7 t0 -65.28 96.02 0.21 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.193 -0.458 . . . . 74.11 110.82 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.66 -16.16 9.83 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.234 -0.439 . . . . 72.25 110.911 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -79.01 -16.35 57.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.122 -0.49 . . . . 73.32 110.831 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 23.7 mm-40 -84.61 -171.48 3.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.22 -0.445 . . . . 63.2 110.956 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 177' ' ' ARG . . . . . 0.43 ' HG3' ' HA3' ' A' ' 185' ' ' GLY . 0.0 OUTLIER -115.91 118.66 33.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.156 -0.474 . . . . 63.14 110.854 -179.941 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 178' ' ' TRP . . . . . 0.401 ' CE3' ' HB ' ' A' ' 186' ' ' ILE . 45.8 m95 -117.01 144.3 44.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.145 -0.479 . . . . 72.31 110.909 -179.95 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 179' ' ' THR . . . . . 0.508 ' HA ' HD11 ' A' ' 100' ' ' LEU . 12.3 t -178.04 163.65 1.76 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.211 -0.449 . . . . 74.13 111.132 -179.936 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -125.25 -69.7 0.78 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.274 -0.421 . . . . 45.33 110.885 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -63.2 -13.24 48.27 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.788 -0.72 . . . . 62.41 112.478 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 182' ' ' SER . . . . . 0.491 ' HB3' HG21 ' A' ' 179' ' ' THR . 0.3 OUTLIER -93.14 -24.31 18.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.939 0.399 . . . . 64.5 110.85 -179.788 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 86.6 p 37.93 43.74 0.55 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 64.12 110.888 -179.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -107.84 -33.54 7.21 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.071 -0.513 . . . . 74.2 110.919 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 185' ' ' GLY . . . . . 0.43 ' HA3' ' HG3' ' A' ' 177' ' ' ARG . . . -112.67 -145.11 9.44 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.711 -0.756 . . . . 73.01 112.525 179.872 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 186' ' ' ILE . . . . . 1.05 HG21 HD21 ' A' ' 156' ' ' LEU . 11.5 mm -78.87 97.8 2.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.9 0.381 . . . . 73.22 111.121 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 22.1 m-80 -44.55 118.17 1.49 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.216 -0.447 . . . . 71.31 110.884 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 188' ' ' PHE . . . . . 0.632 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.4 t80 -53.96 -36.37 62.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.145 -0.479 . . . . 75.45 110.877 179.998 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . 0.453 HD21 ' CG ' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -67.18 -47.16 71.76 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.164 -0.471 . . . . 52.02 110.898 -179.932 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 6.2 t80 -69.24 -38.93 78.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.186 -0.461 . . . . 74.22 110.92 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 191' ' ' ALA . . . . . 0.615 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -72.01 -35.83 69.53 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.125 -0.489 . . . . 50.03 111.134 179.837 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 192' ' ' ALA . . . . . 0.615 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -56.98 -45.0 83.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.195 -0.457 . . . . 52.11 111.078 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 193' ' ' THR . . . . . 0.594 HG21 ' HE1' ' A' ' 224' ' ' PHE . 0.3 OUTLIER -58.52 -41.25 85.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.217 -0.447 . . . . 72.43 111.153 -179.919 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 13.7 t-160 -72.77 -45.41 58.72 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.18 -0.464 . . . . 71.44 110.877 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -69.42 -47.41 64.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.206 -0.452 . . . . 71.01 111.095 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 196' ' ' LEU . . . . . 0.75 HD12 ' CD1' ' A' ' 113' ' ' LEU . 4.0 mm? -66.26 -43.18 87.19 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.244 -0.434 . . . . 74.51 110.903 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -60.67 -24.29 61.94 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.79 -0.719 . . . . 52.23 112.472 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 198' ' ' HIS . . . . . 0.652 ' CD2' HG21 ' A' ' 69' ' ' VAL . 5.7 m-70 -68.08 -42.69 80.01 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.807 0.337 . . . . 75.21 110.928 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . 0.451 ' O ' ' HD3' ' A' ' 162' ' ' PRO . 41.4 t -62.15 -23.3 66.5 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.182 -0.463 . . . . 71.13 110.91 -179.854 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 1.6 mt -85.23 2.58 43.25 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.075 -0.511 . . . . 64.13 110.965 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 84.91 -9.37 66.14 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.817 -0.706 . . . . 50.41 112.434 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 202' ' ' MET . . . . . 0.417 ' CE ' ' HB ' ' A' ' 234' ' ' ILE . 0.0 OUTLIER -57.55 130.47 46.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.782 0.325 . . . . 63.21 110.915 179.962 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -101.03 175.12 25.92 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.777 -0.725 . . . . 64.44 112.451 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 17.3 m-70 -68.09 163.47 22.4 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.766 0.317 . . . . 74.32 110.909 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -127.06 156.36 41.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.228 -0.442 . . . . 53.34 110.899 -179.788 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 5.6 p -87.65 -4.28 58.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.208 -0.451 . . . . 72.22 110.817 -179.75 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 207' ' ' ASP . . . . . 0.469 ' HB2' ' HB2' ' A' ' 210' ' ' ALA . 24.4 m-20 -71.29 133.62 85.3 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-O 121.635 0.731 . . . . 65.11 110.811 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 -6.0 17.55 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.682 2.255 . . . . 74.53 112.297 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 -127.64 26.49 5.91 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.252 -0.431 . . . . 63.52 110.841 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 210' ' ' ALA . . . . . 0.469 ' HB2' ' HB2' ' A' ' 207' ' ' ASP . . . -87.4 145.65 26.21 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.234 -0.439 . . . . 62.23 111.071 179.821 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 211' ' ' VAL . . . . . 0.49 HG21 HG21 ' A' ' 193' ' ' THR . 0.4 OUTLIER -67.49 -27.35 38.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.207 -0.451 . . . . 62.04 111.128 179.959 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 35.6 mmm -93.83 6.13 49.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.454 . . . . 75.22 110.866 179.881 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 213' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -55.91 111.87 3.66 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.666 0.746 . . . . 73.43 110.955 -179.877 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.79 -17.79 37.24 Favored 'Trans proline' 0 C--N 1.341 0.135 0 C-N-CA 122.688 2.259 . . . . 63.01 112.32 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.13 60.48 5.93 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.232 -0.44 . . . . 74.24 111.1 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.367 0 CA-C-N 116.191 -0.459 . . . . 74.14 110.914 -179.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 224' ' ' PHE . . . . . 0.594 ' HE1' HG21 ' A' ' 193' ' ' THR . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.903 0.382 . . . . 65.01 110.864 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.86 158.59 43.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.087 -0.506 . . . . 64.24 110.963 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 226' ' ' LEU . . . . . 0.7 ' HB3' HD11 ' A' ' 231' ' ' ILE . 50.4 mt -69.74 148.92 48.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.231 -0.44 . . . . 53.44 110.908 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 227' ' ' SER . . . . . 0.492 ' O ' HD12 ' A' ' 231' ' ' ILE . 0.0 OUTLIER -87.17 148.49 25.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.173 -0.467 . . . . 74.21 110.886 -179.96 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.7 -64.07 0.96 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.158 -0.474 . . . . 74.54 110.919 -179.953 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -55.66 -27.68 51.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.171 -0.468 . . . . 72.22 110.852 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -70.05 -49.36 51.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.157 -0.474 . . . . 74.23 110.857 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 231' ' ' ILE . . . . . 0.7 HD11 ' HB3' ' A' ' 226' ' ' LEU . 8.3 mt -69.39 -44.27 80.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.22 -0.446 . . . . 73.41 111.135 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 1.2 ptmt -56.41 -32.58 64.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.139 -0.482 . . . . 65.42 110.901 179.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -64.95 -50.54 57.5 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.791 -0.719 . . . . 63.43 112.464 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 234' ' ' ILE . . . . . 0.497 HD11 ' CE1' ' A' ' 238' ' ' TYR . 8.0 tt -73.82 -31.11 30.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.817 0.342 . . . . 71.54 111.16 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -61.67 -23.7 66.25 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.158 -0.474 . . . . 70.33 110.889 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 236' ' ' LYS . . . . . 0.433 ' HE2' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.39 -24.61 59.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.252 -0.431 . . . . 51.21 110.884 179.947 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 237' ' ' LEU . . . . . 0.748 HD22 ' HD2' ' A' ' 83' ' ' LYS . 9.2 tt -93.02 -30.27 15.4 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.252 -0.431 . . . . 75.41 110.918 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 238' ' ' TYR . . . . . 0.497 ' CE1' HD11 ' A' ' 234' ' ' ILE . 46.9 m-85 -92.27 -35.4 13.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.167 -0.47 . . . . 51.24 110.921 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.26 0 C-N-CA 120.679 -0.772 . . . . 32.22 112.384 -179.954 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 6.6 t-105 . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.679 0.276 . . . . 71.22 110.889 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -73.32 -36.39 66.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.294 -0.412 . . . . 72.51 110.919 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -63.12 -38.09 89.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.158 -0.474 . . . . 61.24 110.851 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.66 ' HB1' ' CE ' ' A' ' 62' ' ' MET . . . -64.23 -43.66 94.27 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.207 -0.451 . . . . 54.34 111.062 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.54 ' NE2' HD12 ' A' ' 35' ' ' LEU . 0.6 OUTLIER -62.2 -43.09 99.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.215 -0.448 . . . . 73.12 110.855 -179.89 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -73.66 -31.52 63.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.208 -0.451 . . . . 72.4 110.888 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -70.74 -36.41 73.13 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.23 -0.441 . . . . 75.11 110.89 -179.819 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.686 HD13 ' O ' ' A' ' 19' ' ' LEU . 3.1 tm? -71.91 -21.04 61.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.149 -0.478 . . . . 72.51 110.973 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 5.1 ptmt -74.85 -34.62 62.31 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.156 -0.475 . . . . 74.41 110.918 179.822 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.04 -27.17 48.71 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.212 -0.449 . . . . 74.05 110.875 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -75.42 2.12 12.24 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.207 -0.451 . . . . 74.31 110.916 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.423 ' O ' ' HB2' ' A' ' 70' ' ' PRO . 7.8 m-85 . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.166 -0.47 . . . . 72.55 110.976 -179.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.54 HD12 ' NE2' ' A' ' 16' ' ' GLN . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.766 0.317 . . . . 72.52 110.895 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.524 ' N ' HD23 ' A' ' 35' ' ' LEU . 0.7 OUTLIER -61.95 -51.05 69.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.244 -0.435 . . . . 73.13 110.944 179.897 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.7 -36.79 85.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.175 -0.466 . . . . 63.32 111.096 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.47 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 1.1 tttp -69.5 -49.16 57.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.191 -0.459 . . . . 72.32 110.869 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.783 HD11 HD22 ' A' ' 54' ' ' LEU . 2.1 mt -61.84 -35.62 78.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.251 -0.431 . . . . 72.11 110.909 179.968 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.74 -45.92 88.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.187 -0.461 . . . . 62.43 110.891 179.799 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.47 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 3.5 pt-20 -62.81 -32.43 73.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.26 -0.427 . . . . 75.11 110.841 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.433 ' HE3' ' CZ ' ' A' ' 46' ' ' PHE . 1.5 ttt -68.05 -34.25 76.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.18 -0.464 . . . . 63.43 110.868 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.479 ' CD ' HD11 ' A' ' 48' ' ' LEU . 2.6 mm100 -57.26 -39.22 75.19 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.265 -0.425 . . . . 74.45 110.983 -179.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.4 mmtt -68.78 -28.76 67.07 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.14 -0.482 . . . . 71.43 110.912 179.943 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -70.59 -43.84 68.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 73.32 110.881 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.443 ' CB ' HD23 ' A' ' 48' ' ' LEU . 10.3 m-85 -82.05 -34.92 29.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.157 -0.474 . . . . 70.43 110.873 -179.905 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 102.65 -8.36 54.54 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.785 -0.722 . . . . 64.34 112.575 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.479 HD11 ' CD ' ' A' ' 43' ' ' GLN . 0.9 OUTLIER -59.87 136.43 90.29 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.665 0.745 . . . . 64.11 110.874 -179.916 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.69 -51.8 0.37 Allowed 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.715 2.277 . . . . 74.5 112.369 179.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.475 HD12 HG23 ' A' ' 58' ' ' VAL . 0.9 OUTLIER -51.11 108.25 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.219 -0.446 . . . . 71.22 111.102 179.924 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 7.4 p -96.24 156.62 16.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.119 -0.492 . . . . 73.25 111.16 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 58.76 20.22 46.57 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.783 -0.722 . . . . 64.24 112.441 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . 0.452 ' O ' HG11 ' A' ' 58' ' ' VAL . 28.4 mmt -104.99 142.76 34.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.856 0.36 . . . . 75.23 110.805 -179.919 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.783 HD22 HD11 ' A' ' 39' ' ' LEU . 32.4 tp -161.9 77.91 0.52 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.194 -0.457 . . . . 73.4 110.925 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -179.04 -29.8 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.198 -0.456 . . . . 44.35 110.869 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 26.7 t -91.45 -98.55 0.12 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.206 -0.452 . . . . 75.25 110.842 -179.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 11.1 tpt180 -84.8 -31.08 24.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.123 -0.49 . . . . 61.22 110.823 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.475 HG23 HD12 ' A' ' 50' ' ' ILE . 88.9 t -63.94 -43.27 97.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.158 -0.473 . . . . 70.12 111.159 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.445 HD13 ' HA ' ' A' ' 59' ' ' ILE . 0.4 OUTLIER -69.05 -30.83 47.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.12 -0.491 . . . . 74.43 111.188 179.921 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.52 -43.73 93.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.18 -0.464 . . . . 73.45 110.904 179.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.731 HG21 HG22 ' A' ' 215' ' ' THR . 0.0 OUTLIER -76.18 -29.82 19.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.092 -0.504 . . . . 74.52 111.123 179.973 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . 0.66 ' CE ' ' HB1' ' A' ' 15' ' ' ALA . 10.1 mmm -68.91 -26.64 65.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.454 . . . . 74.01 110.84 179.845 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -100.07 -24.99 14.45 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.239 -0.437 . . . . 42.22 110.909 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 6.6 mtmp? -85.27 152.6 58.42 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.533 0.682 . . . . 65.34 110.929 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 152.45 69.35 Favored 'Trans proline' 0 N--CA 1.466 -0.138 0 C-N-CA 122.76 2.307 . . . . 72.11 112.303 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 2.1 ttm180 -147.99 -83.69 0.11 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.201 -0.454 . . . . 71.51 110.853 -179.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -145.72 156.57 43.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.184 -0.462 . . . . 55.3 110.882 -179.933 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.708 ' HA2' HG23 ' A' ' 155' ' ' THR . . . -94.98 9.81 70.29 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.704 -0.76 . . . . 64.23 112.51 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.515 HG12 ' HD2' ' A' ' 70' ' ' PRO . 0.2 OUTLIER -100.33 135.38 20.28 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.574 0.702 . . . . 74.23 111.157 -179.973 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . 0.515 ' HD2' HG12 ' A' ' 69' ' ' VAL . 53.1 Cg_endo -69.77 159.81 52.0 Favored 'Trans proline' 0 N--CA 1.465 -0.196 0 C-N-CA 122.709 2.273 . . . . 63.44 112.369 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -94.37 6.66 48.05 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.272 -0.422 . . . . 74.45 110.862 179.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.159 -0.473 . . . . 53.43 111.137 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo . . . . . 0 C--O 1.231 0.16 0 CA-C-O 120.945 0.31 . . . . 71.11 112.363 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.683 ' HD3' HD22 ' A' ' 237' ' ' LEU . 9.7 mtpt -117.17 148.79 41.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.229 -0.441 . . . . 64.45 110.91 179.846 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . 0.545 ' CZ3' HG11 ' A' ' 89' ' ' VAL . 39.2 m0 -47.22 109.49 0.21 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.217 -0.447 . . . . 73.31 110.884 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.0 -5.28 11.97 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.261 -0.427 . . . . 65.3 111.151 -180.0 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -61.83 164.42 6.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 70.34 110.817 -179.844 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 11.5 mmtt -70.91 -30.66 67.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.056 -0.52 . . . . 71.12 110.953 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.422 ' HA ' ' O ' ' A' ' 123' ' ' HIS . 0.3 OUTLIER -154.02 144.92 14.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.258 -0.428 . . . . 74.14 111.092 179.879 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.545 HG11 ' CZ3' ' A' ' 84' ' ' TRP . 5.5 t -130.64 137.51 55.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.206 -0.452 . . . . 72.25 111.165 179.838 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.794 HG22 ' HB3' ' A' ' 125' ' ' ARG . 3.5 p -117.71 167.97 10.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 71.01 111.151 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.446 ' O ' HG21 ' A' ' 127' ' ' VAL . 3.7 p90 -150.05 146.58 27.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.251 -0.431 . . . . 70.51 110.93 -179.956 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.473 ' HB3' ' HB3' ' A' ' 132' ' ' ALA . 5.6 ttt-85 -149.43 139.75 22.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.113 -0.494 . . . . 71.25 110.811 -179.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.505 HD11 ' HA ' ' A' ' 106' ' ' ASP . 10.8 mm -74.75 134.47 29.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.144 -0.48 . . . . 72.4 111.176 179.866 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.71 HG22 ' SD ' ' A' ' 135' ' ' MET . 10.7 t -90.03 -40.68 13.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.465 . . . . 60.2 111.137 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 2.5 t -139.63 167.06 22.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.21 -0.45 . . . . 64.24 110.828 -179.813 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 15.6 p90 -114.93 149.96 36.44 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.115 -0.493 . . . . 72.25 110.945 -179.904 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.55 ' OG1' HG21 ' A' ' 105' ' ' VAL . 0.2 OUTLIER -83.22 140.98 32.22 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.114 -0.494 . . . . 64.11 111.113 -179.973 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.33 -8.47 55.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 72.14 110.806 -179.957 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -96.82 -25.61 15.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.252 -0.431 . . . . 74.13 110.818 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.658 HD21 ' HA ' ' A' ' 179' ' ' THR . 0.8 OUTLIER -135.84 153.44 77.18 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.632 0.73 . . . . 72.52 110.9 -179.944 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . 0.618 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.4 Cg_endo -69.79 151.12 68.81 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.666 2.244 . . . . 73.11 112.361 179.919 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 5.2 t-160 -53.96 -25.72 22.16 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.234 -0.439 . . . . 74.11 110.868 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.618 HG22 ' HB2' ' A' ' 101' ' ' PRO . 15.1 tt -75.57 -38.33 38.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.212 -0.449 . . . . 74.02 111.15 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . 0.665 ' O ' HD22 ' A' ' 108' ' ' LEU . 3.1 m -69.2 -39.49 78.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.147 -0.479 . . . . 52.11 111.119 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.751 ' O ' HG13 ' A' ' 109' ' ' VAL . 92.9 t -72.93 -45.41 55.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.214 -0.448 . . . . 71.51 111.143 179.901 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.636 ' O ' HG22 ' A' ' 109' ' ' VAL . 49.8 t0 -61.5 -44.55 96.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.13 -0.486 . . . . 63.44 110.92 179.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 1.7 ptm180 -69.93 -33.55 72.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.171 -0.468 . . . . 75.02 110.854 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.665 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -60.64 -49.07 79.02 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.15 -0.477 . . . . 71.04 110.954 -179.97 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.751 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.4 m -55.61 -42.2 67.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.199 -0.455 . . . . 72.31 111.132 179.791 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.472 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 34.9 t -70.19 -34.16 72.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.157 -0.474 . . . . 72.14 110.889 -179.854 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.454 ' CG ' HD21 ' A' ' 189' ' ' LEU . 0.4 OUTLIER -62.56 -33.36 74.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.091 -0.504 . . . . 74.35 110.842 -179.998 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -95.09 -40.9 9.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.26 -0.427 . . . . 74.32 111.085 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.739 ' CD1' HD12 ' A' ' 196' ' ' LEU . 0.4 OUTLIER -65.65 -33.12 75.16 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.254 -0.43 . . . . 72.0 110.914 -179.982 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 29.6 t-20 -64.83 -40.95 96.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.177 -0.465 . . . . 72.34 110.861 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . 0.72 ' O ' HD11 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -57.8 -34.62 69.83 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.158 -0.473 . . . . 54.12 110.895 179.953 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 9.1 m95 -66.73 -52.36 45.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.186 -0.461 . . . . 75.23 110.887 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' GLY . . . . . 0.457 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -59.96 -37.39 92.59 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.745 -0.74 . . . . 73.32 112.485 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.4 mmpt? -61.82 -16.86 53.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.777 0.322 . . . . 72.42 110.91 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.798 ' HG2' HD13 ' A' ' 226' ' ' LEU . 0.4 OUTLIER -101.01 13.27 35.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.249 -0.432 . . . . 75.24 110.885 179.96 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 0.457 ' CG1' ' HA2' ' A' ' 117' ' ' GLY . 2.2 pt -147.16 146.39 25.4 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.641 0.734 . . . . 71.34 111.156 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.72 6.22 1.38 Allowed 'Trans proline' 0 C--O 1.232 0.225 0 C-N-CA 122.809 2.339 . . . . 72.21 112.318 179.895 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.442 ' HA ' HD23 ' A' ' 122' ' ' LEU . 4.9 mt -62.52 -156.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.223 -0.444 . . . . 73.22 110.963 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.422 ' O ' ' HA ' ' A' ' 88' ' ' VAL . 3.8 t60 -158.67 127.37 5.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.223 -0.444 . . . . 74.12 110.862 179.851 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 11.5 m-30 -110.49 142.85 41.7 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.191 -0.459 . . . . 75.54 110.907 -179.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.794 ' HB3' HG22 ' A' ' 90' ' ' THR . 0.0 OUTLIER -117.96 140.17 50.12 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.162 -0.472 . . . . 75.14 110.944 -179.968 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.79 142.18 32.83 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.228 -0.442 . . . . 72.22 110.868 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . 0.818 HG11 ' HB2' ' A' ' 132' ' ' ALA . 30.3 m -103.23 140.33 21.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.189 -0.459 . . . . 50.13 111.131 179.852 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.402 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -156.41 -27.54 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.205 -0.452 . . . . 74.43 111.129 179.941 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' TRP . . . . . 0.402 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -135.35 109.2 8.1 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.174 -0.467 . . . . 71.25 110.939 179.994 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.97 -158.52 14.83 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.757 -0.735 . . . . 62.11 112.498 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.9 156.29 17.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.8 0.333 . . . . 63.25 111.13 -179.841 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . 0.818 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -111.59 165.46 11.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.172 -0.467 . . . . 51.34 111.096 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -66.38 -62.58 1.39 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.23 -0.441 . . . . 75.41 110.907 179.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . 0.43 HG22 HD13 ' A' ' 136' ' ' ILE . 4.5 mp -82.72 142.55 13.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.112 -0.494 . . . . 70.51 111.148 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . 0.71 ' SD ' HG22 ' A' ' 94' ' ' VAL . 27.9 mmt -113.14 119.25 37.18 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.172 -0.467 . . . . 72.43 110.843 179.861 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.438 HG21 HG11 ' A' ' 109' ' ' VAL . 1.0 OUTLIER -105.61 89.91 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.191 -0.459 . . . . 70.04 111.147 179.928 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -129.93 167.92 21.5 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.771 -0.728 . . . . 63.34 112.501 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 138' ' ' PHE . . . . . 0.562 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 32.7 m-85 -104.89 149.96 25.26 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.828 0.347 . . . . 74.01 110.848 -179.845 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.562 ' HB2' ' O ' ' A' ' 138' ' ' PHE . . . 169.59 165.93 0.05 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.158 -0.473 . . . . 71.21 111.08 179.851 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 4.6 ptt85 -109.45 174.27 5.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.227 -0.442 . . . . 62.21 110.908 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . 0.498 ' H ' ' HA ' ' A' ' 149' ' ' PHE . . . -55.03 -16.68 8.48 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.695 -0.764 . . . . 74.24 112.528 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 142' ' ' ALA . . . . . 0.502 ' HB2' ' CD2' ' A' ' 149' ' ' PHE . . . -91.45 13.13 18.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.817 0.342 . . . . 75.03 111.115 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 143' ' ' HIS . . . . . 0.467 ' HB3' ' HB1' ' A' ' 139' ' ' ALA . 4.1 p80 -80.52 -0.99 39.98 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.199 -0.455 . . . . 71.11 110.911 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 107.3 45.15 1.18 Allowed Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.719 -0.753 . . . . 45.51 112.408 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 39.9 p-10 -146.05 168.82 20.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.843 0.354 . . . . 72.14 110.877 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.0 164.96 9.62 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.142 -0.481 . . . . 51.25 110.881 -179.744 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 64.73 132.37 0.03 OUTLIER Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.65 0.738 . . . . 73.4 110.916 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.67 151.02 69.47 Favored 'Trans proline' 0 C--O 1.231 0.125 0 C-N-CA 122.715 2.276 . . . . 74.53 112.342 179.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 149' ' ' PHE . . . . . 0.502 ' CD2' ' HB2' ' A' ' 142' ' ' ALA . 7.0 p90 -53.94 -41.94 68.28 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.227 -0.442 . . . . 63.52 110.906 179.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 76.69 -22.69 0.27 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.118 -0.492 . . . . 63.11 110.861 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . 0.434 ' H ' ' C ' ' A' ' 149' ' ' PHE . . . 74.8 -149.55 39.94 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.812 -0.709 . . . . 71.41 112.472 -179.914 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.71 142.35 47.89 Favored 'Trans proline' 0 C--N 1.341 0.137 0 C-N-CA 122.666 2.244 . . . . 75.11 112.349 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . 0.448 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 104.34 -139.45 14.58 Favored Glycine 0 N--CA 1.453 -0.197 0 C-N-CA 120.669 -0.777 . . . . 70.32 112.456 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 154' ' ' ASN . . . . . 0.448 ' C ' ' O ' ' A' ' 153' ' ' GLY . 4.0 p30 -34.77 140.93 0.07 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.963 0.411 . . . . 73.25 110.895 -179.871 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 155' ' ' THR . . . . . 0.708 HG23 ' HA2' ' A' ' 68' ' ' GLY . 1.6 m 78.21 107.19 0.07 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.136 -0.484 . . . . 44.41 111.141 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 156' ' ' LEU . . . . . 0.995 HD21 HG21 ' A' ' 186' ' ' ILE . 0.8 OUTLIER -93.8 -54.69 3.52 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.211 -0.449 . . . . 75.02 110.921 179.921 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . 0.592 ' HB1' ' O ' ' A' ' 171' ' ' HIS . . . -158.56 148.0 19.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.177 -0.465 . . . . 71.42 111.069 179.843 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 26.5 p-80 -109.67 122.47 47.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.21 -0.45 . . . . 72.02 110.824 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . 0.446 ' H ' HG22 ' A' ' 69' ' ' VAL . . . -109.59 160.63 16.09 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.221 -0.445 . . . . 74.42 111.13 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 11.8 m-85 -118.4 156.29 29.23 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.208 -0.451 . . . . 75.31 110.865 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 161' ' ' ALA . . . . . 0.739 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -82.85 165.29 42.42 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.543 0.687 . . . . 61.04 111.127 179.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 162' ' ' PRO . . . . . 0.739 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.6 Cg_endo -69.89 67.69 1.8 Allowed 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.668 2.246 . . . . 74.44 112.345 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -127.82 107.11 0.84 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.733 -0.746 . . . . 61.41 112.527 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 164' ' ' THR . . . . . 0.485 HG22 ' H ' ' A' ' 165' ' ' GLY . 0.2 OUTLIER 72.83 174.39 0.29 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.888 0.375 . . . . 73.1 111.119 -179.886 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 165' ' ' GLY . . . . . 0.485 ' H ' HG22 ' A' ' 164' ' ' THR . . . -50.06 -57.59 9.82 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.776 -0.725 . . . . 74.03 112.433 -179.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -60.48 -18.03 48.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.895 0.378 . . . . 65.12 110.964 -179.937 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -68.87 146.8 45.5 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.766 -0.731 . . . . 43.43 112.55 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 81.33 11.78 82.94 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.751 -0.738 . . . . 74.31 112.487 -179.871 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 57.6 m-20 -79.8 148.83 31.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.848 0.356 . . . . 63.41 110.802 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.26 130.41 55.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.148 -0.478 . . . . 74.21 111.084 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 171' ' ' HIS . . . . . 0.592 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 20.6 m170 -126.86 132.4 50.96 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.218 -0.446 . . . . 72.53 110.911 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 32.2 m-85 -113.7 139.56 48.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.268 -0.424 . . . . 71.44 110.841 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 55.0 t0 -71.63 100.69 2.35 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.129 -0.487 . . . . 74.11 110.809 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.71 -16.73 11.86 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.223 -0.444 . . . . 72.25 110.937 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -77.99 -16.26 58.27 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.104 -0.498 . . . . 73.32 110.911 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -85.05 -174.39 5.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.157 -0.474 . . . . 63.2 110.864 -179.873 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 6.4 mtt85 -112.33 115.14 28.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.156 -0.474 . . . . 63.14 110.85 -179.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 58.9 m95 -115.97 138.5 51.14 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.153 -0.476 . . . . 72.31 110.882 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 179' ' ' THR . . . . . 0.658 ' HA ' HD21 ' A' ' 100' ' ' LEU . 7.3 t -176.87 163.57 2.25 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.241 -0.436 . . . . 74.13 111.175 -179.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -125.06 -68.71 0.83 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.277 -0.419 . . . . 45.33 110.84 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -65.14 -11.68 52.59 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.757 -0.735 . . . . 62.41 112.479 -179.9 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 182' ' ' SER . . . . . 0.524 ' HB3' HG21 ' A' ' 179' ' ' THR . 0.3 OUTLIER -95.38 -24.24 16.8 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.845 0.355 . . . . 64.5 110.84 -179.698 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 183' ' ' SER . . . . . 0.429 ' C ' ' O ' ' A' ' 182' ' ' SER . 89.9 p 34.97 58.87 0.73 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.086 -0.506 . . . . 64.12 110.869 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 2.2 tp -116.73 -33.67 4.74 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.105 -0.498 . . . . 74.2 110.887 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -119.58 -138.41 5.71 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.754 -0.736 . . . . 73.01 112.489 179.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 186' ' ' ILE . . . . . 0.995 HG21 HD21 ' A' ' 156' ' ' LEU . 6.1 mm -79.51 98.75 3.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.897 0.379 . . . . 73.22 111.142 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -46.65 127.25 9.37 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.132 -0.486 . . . . 71.31 110.886 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 188' ' ' PHE . . . . . 0.718 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.2 t80 -60.66 -37.39 81.42 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.217 -0.447 . . . . 75.45 110.93 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . 0.454 HD21 ' CG ' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -66.7 -47.89 70.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.129 -0.487 . . . . 52.02 110.933 179.942 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 48.8 t80 -69.7 -38.57 77.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.464 . . . . 74.22 110.948 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 191' ' ' ALA . . . . . 0.643 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -72.88 -35.91 67.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.085 -0.507 . . . . 50.03 111.068 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 192' ' ' ALA . . . . . 0.692 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -57.26 -45.23 84.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.194 -0.457 . . . . 52.11 111.057 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 193' ' ' THR . . . . . 0.593 HG21 ' HE1' ' A' ' 224' ' ' PHE . 0.2 OUTLIER -58.39 -41.94 86.0 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.159 -0.473 . . . . 72.43 111.167 -179.883 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 4.9 t60 -72.71 -45.56 58.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.199 -0.455 . . . . 71.44 110.853 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -68.02 -47.96 67.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.202 -0.454 . . . . 71.01 111.079 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 196' ' ' LEU . . . . . 0.739 HD12 ' CD1' ' A' ' 113' ' ' LEU . 4.4 mm? -63.71 -37.32 86.92 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.199 -0.455 . . . . 74.51 110.954 -179.929 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -61.97 -26.46 67.33 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.783 -0.723 . . . . 52.23 112.541 179.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 198' ' ' HIS . . . . . 0.493 ' CD2' HG21 ' A' ' 69' ' ' VAL . 6.1 m-70 -68.83 -42.87 76.61 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.753 0.311 . . . . 75.21 110.84 -179.969 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.18 -27.59 65.82 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.452 . . . . 71.13 110.888 -179.765 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -84.78 0.17 51.66 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.041 -0.527 . . . . 64.13 110.938 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 88.36 -9.37 75.65 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.697 -0.764 . . . . 50.41 112.444 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 202' ' ' MET . . . . . 0.464 ' CE ' ' HB ' ' A' ' 234' ' ' ILE . 0.4 OUTLIER -60.33 127.14 30.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.838 0.352 . . . . 63.21 110.886 -179.995 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -101.03 178.86 28.44 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.781 -0.724 . . . . 64.44 112.486 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 18.4 m-70 -68.94 159.65 32.29 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.821 0.343 . . . . 74.32 110.86 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -122.25 157.36 31.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.204 -0.453 . . . . 53.34 110.807 -179.764 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -87.88 -4.43 58.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.084 -0.507 . . . . 72.22 110.863 -179.827 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.44 137.49 83.68 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.681 0.753 . . . . 65.11 110.871 179.943 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 -6.68 19.17 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.694 2.263 . . . . 74.53 112.348 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 -127.61 33.48 4.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.213 -0.449 . . . . 63.52 110.896 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 210' ' ' ALA . . . . . 0.51 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.14 145.99 26.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.156 -0.475 . . . . 62.23 111.104 179.851 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -73.47 -26.86 22.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.213 -0.449 . . . . 62.04 111.2 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 212' ' ' MET . . . . . 0.451 ' HE1' ' HB2' ' A' ' 202' ' ' MET . 16.3 tpp -94.76 6.94 47.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.14 -0.482 . . . . 75.22 110.846 179.953 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 213' ' ' TYR . . . . . 0.429 ' HB2' ' O ' ' A' ' 210' ' ' ALA . 0.1 OUTLIER -56.2 127.32 70.21 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.703 0.763 . . . . 73.43 110.929 -179.857 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.77 -29.57 23.63 Favored 'Trans proline' 0 C--O 1.231 0.159 0 C-N-CA 122.687 2.258 . . . . 63.01 112.357 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 215' ' ' THR . . . . . 0.731 HG22 HG21 ' A' ' 61' ' ' ILE . 60.4 p -84.42 62.23 7.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.214 -0.448 . . . . 74.24 111.205 179.964 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.247 -0.433 . . . . 74.14 110.906 -179.909 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 224' ' ' PHE . . . . . 0.593 ' HE1' HG21 ' A' ' 193' ' ' THR . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.863 0.363 . . . . 65.01 110.901 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -143.6 159.24 42.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.153 -0.476 . . . . 64.24 110.964 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 226' ' ' LEU . . . . . 0.798 HD13 ' HG2' ' A' ' 119' ' ' GLU . 29.9 mt -65.5 148.79 51.14 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.286 -0.415 . . . . 53.44 110.924 179.93 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 227' ' ' SER . . . . . 0.51 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 1.8 t -87.65 151.71 22.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.216 -0.447 . . . . 74.21 110.83 -179.922 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.54 -63.0 1.15 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.115 -0.493 . . . . 74.54 110.89 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -55.7 -27.47 50.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.163 -0.471 . . . . 72.22 110.842 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -70.58 -49.41 48.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.279 -0.418 . . . . 74.23 110.885 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 231' ' ' ILE . . . . . 0.707 HD11 ' HB3' ' A' ' 226' ' ' LEU . 9.5 mt -69.34 -45.03 79.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 73.41 111.101 179.972 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.21 -33.18 67.25 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.238 -0.437 . . . . 65.42 110.867 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -63.12 -49.49 71.09 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.81 -0.709 . . . . 63.43 112.467 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 234' ' ' ILE . . . . . 0.555 HD11 ' CE1' ' A' ' 238' ' ' TYR . 6.8 tt -72.59 -29.1 29.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.814 0.34 . . . . 71.54 111.16 180.0 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -60.23 -28.51 68.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.159 -0.473 . . . . 70.33 110.944 179.945 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 236' ' ' LYS . . . . . 0.442 ' HD3' ' N ' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.67 -27.3 60.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.241 -0.436 . . . . 51.21 110.92 179.915 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 237' ' ' LEU . . . . . 0.683 HD22 ' HD3' ' A' ' 83' ' ' LYS . 8.2 tt -97.48 -24.59 15.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.213 -0.449 . . . . 75.41 110.936 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 238' ' ' TYR . . . . . 0.555 ' CE1' HD11 ' A' ' 234' ' ' ILE . 3.8 m-85 -92.31 -35.38 13.78 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.452 . . . . 51.24 110.925 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.328 0 C-N-CA 120.763 -0.732 . . . . 32.22 112.475 179.993 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 15.2 t-105 . . . . . 0 C--O 1.23 0.029 0 CA-C-O 120.742 0.306 . . . . 71.22 110.958 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -73.27 -35.26 66.15 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.236 -0.438 . . . . 72.51 110.825 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.98 -39.26 94.18 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.205 -0.452 . . . . 61.24 110.864 -179.876 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.22 -35.13 69.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.174 -0.466 . . . . 54.34 111.069 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.488 ' NE2' HD12 ' A' ' 35' ' ' LEU . 0.0 OUTLIER -67.31 -40.07 85.97 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.251 -0.431 . . . . 73.12 110.896 -179.899 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -77.18 -31.71 55.61 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.191 -0.459 . . . . 72.4 110.873 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -62.73 -36.16 82.09 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.185 -0.461 . . . . 75.11 110.926 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.745 HD13 ' O ' ' A' ' 19' ' ' LEU . 1.8 tm? -71.38 -21.04 62.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.124 -0.489 . . . . 72.51 110.896 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 4.4 ptmt -74.8 -29.81 61.22 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.206 -0.452 . . . . 74.41 110.928 179.829 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.6 ptp85 -86.59 -28.03 23.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.205 -0.452 . . . . 74.05 110.905 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 13.0 m-85 -68.82 -10.66 58.05 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.157 -0.474 . . . . 74.31 110.814 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.526 ' HB3' HG21 ' A' ' 72' ' ' VAL . 8.3 m-85 . . . . . 0 C--N 1.328 -0.362 0 CA-C-N 116.197 -0.456 . . . . 72.55 110.92 -179.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.488 HD12 ' NE2' ' A' ' 16' ' ' GLN . 2.3 tt . . . . . 0 N--CA 1.458 -0.066 0 CA-C-O 120.837 0.351 . . . . 72.52 110.982 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.415 ' N ' HD23 ' A' ' 35' ' ' LEU . 0.1 OUTLIER -64.09 -51.22 65.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.184 -0.462 . . . . 73.13 110.872 179.935 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.5 -51.04 68.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.076 -0.511 . . . . 63.32 111.138 179.898 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.521 ' HD3' HD12 ' A' ' 19' ' ' LEU . 5.9 tttp -59.94 -49.35 78.03 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.222 -0.445 . . . . 72.32 110.891 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.42 ' O ' ' HG2' ' A' ' 43' ' ' GLN . 0.1 OUTLIER -58.04 -36.4 72.69 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.261 -0.427 . . . . 72.11 110.909 179.922 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.2 tttm -58.99 -45.7 90.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.151 -0.477 . . . . 62.43 110.847 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.484 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 3.2 pt-20 -60.58 -32.62 71.72 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.226 -0.443 . . . . 75.11 110.905 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 7.5 ttt -68.37 -33.99 75.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.197 -0.456 . . . . 63.43 110.892 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.767 ' OE1' HD11 ' A' ' 48' ' ' LEU . 1.3 mm-40 -61.33 -39.66 91.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.242 -0.435 . . . . 74.45 110.964 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.2 mmpt? -72.39 -32.97 66.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 71.43 110.862 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 56.3 t80 -70.63 -40.68 72.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.181 -0.463 . . . . 73.32 110.839 180.0 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.863 ' CZ ' HD13 ' A' ' 61' ' ' ILE . 3.3 m-85 -82.25 -35.16 28.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.185 -0.462 . . . . 70.43 110.819 -179.829 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 104.05 -10.17 51.34 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.784 -0.722 . . . . 64.34 112.489 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.767 HD11 ' OE1' ' A' ' 43' ' ' GLN . 0.8 OUTLIER -60.11 138.13 91.24 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.518 0.675 . . . . 64.11 110.936 -179.93 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.502 ' O ' HG23 ' A' ' 51' ' ' THR . 53.9 Cg_endo -69.77 -53.55 0.26 Allowed 'Trans proline' 0 C--O 1.231 0.151 0 C-N-CA 122.713 2.276 . . . . 74.5 112.35 179.853 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.508 ' CD1' HG23 ' A' ' 58' ' ' VAL . 0.9 OUTLIER -51.9 108.25 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 71.22 111.196 179.934 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.721 HG22 ' CB ' ' A' ' 43' ' ' GLN . 39.8 p -113.96 151.5 32.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.155 -0.475 . . . . 73.25 111.149 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 76.46 -0.61 63.84 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.756 -0.735 . . . . 64.24 112.528 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . 0.511 ' O ' HG21 ' A' ' 58' ' ' VAL . 2.9 mtt -135.22 161.08 36.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.836 0.35 . . . . 75.23 110.892 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.72 ' CD1' HD13 ' A' ' 59' ' ' ILE . 2.8 pp -156.78 128.63 7.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.271 -0.422 . . . . 73.4 110.882 -179.945 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.4 t30 173.01 -28.67 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.165 -0.471 . . . . 44.35 110.836 179.816 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 23.1 p -96.85 -87.09 0.32 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.216 -0.447 . . . . 75.25 110.856 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.701 ' O ' HG23 ' A' ' 61' ' ' ILE . 0.1 OUTLIER -84.49 -34.77 23.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.187 -0.46 . . . . 61.22 110.864 -179.972 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.527 ' O ' HG13 ' A' ' 61' ' ' ILE . 14.1 t -59.94 -46.92 93.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.224 -0.444 . . . . 70.12 111.143 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.72 HD13 ' CD1' ' A' ' 54' ' ' LEU . 4.0 tp -75.61 -32.14 24.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.165 -0.471 . . . . 74.43 111.099 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -59.92 -44.24 94.42 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.208 -0.451 . . . . 73.45 110.884 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.863 HD13 ' CZ ' ' A' ' 46' ' ' PHE . 1.7 pp -67.94 -29.52 45.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.225 -0.443 . . . . 74.52 111.098 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 4.7 mmt -61.68 -39.16 90.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.192 -0.458 . . . . 74.01 110.806 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -90.26 -26.29 20.13 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.275 -0.421 . . . . 42.22 110.935 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 4.1 mtmp? -85.21 133.95 41.73 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.573 0.701 . . . . 65.34 110.864 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.7 149.85 67.83 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.69 2.26 . . . . 72.11 112.368 179.84 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.31 -78.63 0.2 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.198 -0.455 . . . . 71.51 110.875 -179.934 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 16.0 p -145.29 141.51 28.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.186 -0.461 . . . . 55.3 110.852 -179.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.573 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -90.32 17.2 55.16 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.768 -0.729 . . . . 64.23 112.518 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.686 HG12 ' HD2' ' A' ' 70' ' ' PRO . 0.0 OUTLIER -110.52 141.19 23.48 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.556 0.693 . . . . 74.23 111.154 -179.955 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . 0.686 ' HD2' HG12 ' A' ' 69' ' ' VAL . 53.7 Cg_endo -69.75 -179.86 3.2 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.615 2.21 . . . . 63.44 112.367 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -139.33 27.33 2.32 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.211 -0.449 . . . . 74.45 110.902 179.917 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.526 HG21 ' HB3' ' A' ' 23' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 116.207 -0.451 . . . . 53.43 111.128 -179.943 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo . . . . . 0 C--O 1.232 0.213 0 CA-C-O 120.831 0.263 . . . . 71.11 112.362 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.738 ' CD ' HD22 ' A' ' 237' ' ' LEU . 0.0 OUTLIER -140.07 -178.47 5.47 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.237 -0.438 . . . . 64.45 110.898 179.865 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . 0.7 ' CE3' HG21 ' A' ' 89' ' ' VAL . 38.1 m0 -59.11 109.77 0.92 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 73.31 110.958 179.926 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 12.0 t -104.49 -14.87 15.53 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.289 -0.414 . . . . 65.3 111.092 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -56.76 152.45 12.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.261 -0.427 . . . . 70.34 110.87 -179.867 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.95 -30.58 71.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.163 -0.471 . . . . 71.12 110.875 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.58 HG23 ' CD2' ' A' ' 123' ' ' HIS . 0.8 OUTLIER -156.94 144.12 10.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.28 -0.418 . . . . 74.14 111.122 179.86 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.7 HG21 ' CE3' ' A' ' 84' ' ' TRP . 64.7 t -124.36 138.99 52.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.192 -0.458 . . . . 72.25 111.131 179.884 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.676 HG22 ' HB3' ' A' ' 125' ' ' ARG . 1.1 p -115.83 151.14 35.81 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.159 -0.473 . . . . 71.01 111.127 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 5.4 p90 -133.11 146.55 51.71 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.218 -0.447 . . . . 70.51 110.939 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -148.29 138.17 22.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.102 -0.499 . . . . 71.25 110.832 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.421 HD11 ' HA ' ' A' ' 106' ' ' ASP . 11.7 mm -77.59 135.18 26.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.167 -0.47 . . . . 72.4 111.141 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.458 ' HB ' ' HA3' ' A' ' 137' ' ' GLY . 15.3 t -91.37 -40.5 12.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.173 -0.467 . . . . 60.2 111.14 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 3.8 t -141.44 169.44 17.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.145 -0.479 . . . . 64.24 110.859 -179.755 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 12.2 p90 -117.27 150.34 38.95 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.177 -0.465 . . . . 72.25 110.94 -179.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.54 ' OG1' HG21 ' A' ' 105' ' ' VAL . 0.2 OUTLIER -82.87 141.06 32.53 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.145 -0.48 . . . . 64.11 111.17 -179.986 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 2.0 ptt180 -72.42 -8.07 53.09 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.207 -0.451 . . . . 72.14 110.852 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -96.63 -25.94 15.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.218 -0.446 . . . . 74.13 110.801 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.5 HD22 HG21 ' A' ' 104' ' ' THR . 0.7 OUTLIER -135.54 152.67 76.78 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.675 0.75 . . . . 72.52 110.902 -179.974 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . 0.599 ' HB2' HG22 ' A' ' 103' ' ' ILE . 54.1 Cg_endo -69.69 151.04 69.41 Favored 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.706 2.271 . . . . 73.11 112.336 179.915 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 6.0 t-160 -52.91 -25.71 12.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.191 -0.459 . . . . 74.11 110.884 179.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.599 HG22 ' HB2' ' A' ' 101' ' ' PRO . 13.9 tt -76.74 -39.14 31.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.223 -0.444 . . . . 74.02 111.153 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . 0.647 ' O ' HD22 ' A' ' 108' ' ' LEU . 3.4 m -69.07 -40.06 78.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 52.11 111.179 179.938 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.746 HG13 ' CZ ' ' A' ' 188' ' ' PHE . 90.7 t -72.99 -45.35 55.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.213 -0.449 . . . . 71.51 111.137 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.625 ' O ' HG22 ' A' ' 109' ' ' VAL . 48.1 t0 -61.3 -45.11 95.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.164 -0.471 . . . . 63.44 110.835 179.873 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 4.7 ptm85 -69.71 -33.31 72.32 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.196 -0.457 . . . . 75.02 110.902 -179.873 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.647 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -60.38 -48.72 80.53 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.241 -0.436 . . . . 71.04 110.911 179.957 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.732 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.2 m -55.44 -41.89 64.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.173 -0.467 . . . . 72.31 111.104 179.824 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.471 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 47.2 t -70.0 -34.35 73.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.204 -0.453 . . . . 72.14 110.838 -179.787 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.456 ' CG ' HD21 ' A' ' 189' ' ' LEU . 0.4 OUTLIER -62.51 -33.4 74.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.186 -0.461 . . . . 74.35 110.906 179.939 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.416 ' CB ' ' HB3' ' A' ' 192' ' ' ALA . . . -93.27 -40.61 10.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.206 -0.452 . . . . 74.32 111.061 179.846 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.743 ' CD1' HD12 ' A' ' 196' ' ' LEU . 0.7 OUTLIER -64.85 -33.35 75.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.232 -0.44 . . . . 72.0 110.928 -179.937 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -67.31 -40.99 86.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.233 -0.44 . . . . 72.34 110.882 179.88 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . 0.768 ' O ' HD11 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -57.93 -34.35 69.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.184 -0.462 . . . . 54.12 110.921 179.89 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' TRP . . . . . 0.451 ' O ' HG12 ' A' ' 120' ' ' ILE . 6.5 m95 -64.84 -49.6 69.95 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.172 -0.467 . . . . 75.23 110.938 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' GLY . . . . . 0.604 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -73.02 -24.92 74.96 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.801 -0.714 . . . . 73.32 112.468 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.444 ' HE3' ' HA ' ' A' ' 115' ' ' MET . 0.3 OUTLIER -64.52 -13.95 54.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.736 0.303 . . . . 72.42 110.921 -179.985 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.578 ' CD ' HG21 ' A' ' 231' ' ' ILE . 1.7 mm-40 -112.61 13.91 20.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.181 -0.463 . . . . 75.24 110.953 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 0.692 ' CD1' HD12 ' A' ' 122' ' ' LEU . 5.0 pt -148.25 150.08 33.78 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.679 0.752 . . . . 71.34 111.161 179.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 24.51 0.18 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.658 2.239 . . . . 72.21 112.377 179.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.692 HD12 ' CD1' ' A' ' 120' ' ' ILE . 8.3 mt -70.95 -155.03 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.107 -0.497 . . . . 73.22 110.92 179.938 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.58 ' CD2' HG23 ' A' ' 88' ' ' VAL . 3.5 t-160 -172.53 121.51 0.42 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.136 -0.484 . . . . 74.12 110.871 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.9 m-85 -106.97 141.79 37.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.261 -0.427 . . . . 75.54 110.876 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.676 ' HB3' HG22 ' A' ' 90' ' ' THR . 0.0 OUTLIER -115.24 141.17 48.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.191 -0.459 . . . . 75.14 110.897 -179.931 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.88 140.09 35.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.153 -0.476 . . . . 72.22 110.864 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . 0.913 HG11 ' HB2' ' A' ' 132' ' ' ALA . 32.7 m -103.06 138.29 27.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.205 -0.452 . . . . 50.13 111.132 179.866 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.409 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -153.47 -27.66 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.166 -0.47 . . . . 74.43 111.107 179.966 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' TRP . . . . . 0.409 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -134.5 109.26 8.6 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.1 -0.5 . . . . 71.25 110.932 179.95 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.39 -160.5 14.05 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.737 -0.744 . . . . 62.11 112.538 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -101.83 155.64 18.01 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.829 0.347 . . . . 63.25 111.165 -179.883 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . 0.913 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -112.22 165.28 12.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.216 -0.447 . . . . 51.34 111.061 179.932 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -73.11 -57.03 4.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 75.41 110.834 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . 0.708 HG23 ' O ' ' A' ' 168' ' ' GLY . 7.0 mm -82.5 112.79 20.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.189 -0.459 . . . . 70.51 111.102 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 2.0 mmm -96.63 116.6 29.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.115 -0.493 . . . . 72.43 110.903 179.86 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.402 ' O ' HG23 ' A' ' 93' ' ' ILE . 0.8 OUTLIER -106.21 94.64 3.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.238 -0.437 . . . . 70.04 111.096 179.951 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . 0.458 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -134.31 169.46 23.02 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.748 -0.739 . . . . 63.34 112.514 179.856 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 138' ' ' PHE . . . . . 0.544 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 2.8 m-85 -105.13 149.83 25.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.847 0.356 . . . . 74.01 110.844 -179.864 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.544 ' HB2' ' O ' ' A' ' 138' ' ' PHE . . . 171.36 167.71 0.08 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.071 -0.513 . . . . 71.21 111.04 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.446 ' HB3' ' HB3' ' A' ' 149' ' ' PHE . 35.1 mtp180 -103.95 173.04 6.47 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.188 -0.46 . . . . 62.21 110.855 -179.883 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -57.34 -16.23 19.74 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.682 -0.77 . . . . 74.24 112.553 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -94.52 13.34 24.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.804 0.335 . . . . 75.03 111.075 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 143' ' ' HIS . . . . . 0.465 ' HB3' ' HB1' ' A' ' 139' ' ' ALA . 9.2 p80 -71.49 -9.35 58.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 71.11 110.854 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 116.9 50.03 0.41 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.739 -0.743 . . . . 45.51 112.458 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -162.56 170.7 18.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.851 0.358 . . . . 72.14 110.851 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -64.11 175.86 1.15 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.129 -0.487 . . . . 51.25 110.836 -179.719 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 11.2 m-85 64.37 119.36 0.02 OUTLIER Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.634 0.731 . . . . 73.4 110.95 -179.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.69 151.76 69.55 Favored 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.702 2.268 . . . . 74.53 112.327 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 149' ' ' PHE . . . . . 0.446 ' HB3' ' HB3' ' A' ' 140' ' ' ARG . 8.2 p90 -53.44 -42.7 67.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 63.52 110.867 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 75.55 -22.03 0.28 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.187 -0.46 . . . . 63.11 110.888 179.994 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . 0.444 ' H ' ' C ' ' A' ' 149' ' ' PHE . . . 75.64 -156.11 47.63 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.766 -0.731 . . . . 71.41 112.486 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -69.7 142.45 48.22 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.717 2.278 . . . . 75.11 112.362 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . 0.443 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 104.52 -137.27 13.52 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.719 -0.753 . . . . 70.32 112.466 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 154' ' ' ASN . . . . . 0.443 ' C ' ' O ' ' A' ' 153' ' ' GLY . 9.7 p30 -35.03 144.38 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.981 0.419 . . . . 73.25 110.919 -179.923 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 155' ' ' THR . . . . . 0.48 HG23 ' HA2' ' A' ' 68' ' ' GLY . 0.2 OUTLIER 73.49 106.75 0.07 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.178 -0.465 . . . . 44.41 111.119 -179.999 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 156' ' ' LEU . . . . . 0.987 HD21 HG21 ' A' ' 186' ' ' ILE . 0.6 OUTLIER -87.87 -55.16 3.88 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.2 -0.455 . . . . 75.02 110.873 179.962 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . 0.573 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -163.68 148.24 10.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.203 -0.453 . . . . 71.42 111.162 179.764 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 23.8 p-80 -107.01 128.95 54.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.234 -0.439 . . . . 72.02 110.912 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -109.84 160.33 16.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.195 -0.457 . . . . 74.42 111.078 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 10.7 m-30 -106.59 141.66 37.52 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.231 -0.441 . . . . 75.31 110.919 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 161' ' ' ALA . . . . . 0.687 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -73.85 163.48 68.08 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.57 0.7 . . . . 61.04 111.064 179.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 162' ' ' PRO . . . . . 0.687 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 52.8 Cg_endo -69.82 76.15 1.19 Allowed 'Trans proline' 0 C--N 1.341 0.136 0 C-N-CA 122.704 2.269 . . . . 74.44 112.31 -179.943 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -127.46 100.6 0.55 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.725 -0.75 . . . . 61.41 112.445 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 1.3 p 60.21 176.83 0.09 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.856 0.36 . . . . 73.1 111.144 -179.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -52.29 -47.94 54.86 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.733 -0.746 . . . . 74.03 112.439 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.17 -19.67 55.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.884 0.373 . . . . 65.12 110.925 -179.893 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -84.71 168.88 44.15 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.768 -0.729 . . . . 43.43 112.482 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 168' ' ' GLY . . . . . 0.708 ' O ' HG23 ' A' ' 134' ' ' ILE . . . 74.6 16.79 80.0 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.711 -0.757 . . . . 74.31 112.453 -179.916 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -77.33 150.2 35.21 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.818 0.342 . . . . 63.41 110.896 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.67 129.97 56.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.215 -0.448 . . . . 74.21 111.079 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 171' ' ' HIS . . . . . 0.528 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 28.6 m170 -131.3 132.32 44.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.229 -0.442 . . . . 72.53 110.883 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 51.4 m-85 -117.72 139.38 51.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.166 -0.47 . . . . 71.44 110.903 -179.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 59.0 t0 -71.35 98.86 1.85 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.164 -0.471 . . . . 74.11 110.88 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 1.7 pp20? -57.7 -16.33 10.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.225 -0.443 . . . . 72.25 110.859 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -78.95 -16.35 57.07 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.161 -0.472 . . . . 73.32 110.84 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 -82.11 -176.06 5.96 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.259 -0.428 . . . . 63.2 110.973 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 177' ' ' ARG . . . . . 0.436 ' HG3' ' HA3' ' A' ' 185' ' ' GLY . 4.3 ptp180 -116.82 111.86 20.31 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.219 -0.446 . . . . 63.14 110.944 -179.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 5.1 m95 -117.29 152.27 35.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.172 -0.467 . . . . 72.31 110.944 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 179' ' ' THR . . . . . 0.427 ' HA ' HD11 ' A' ' 100' ' ' LEU . 7.8 t 178.41 163.7 0.73 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.27 -0.423 . . . . 74.13 111.142 -179.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -120.55 -75.09 0.59 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.21 -0.45 . . . . 45.33 110.892 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -56.13 -20.18 26.91 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.721 -0.752 . . . . 62.41 112.486 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 182' ' ' SER . . . . . 0.447 ' O ' ' C ' ' A' ' 183' ' ' SER . 0.4 OUTLIER -90.9 -24.7 20.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.963 0.411 . . . . 64.5 110.935 -179.802 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 183' ' ' SER . . . . . 0.447 ' C ' ' O ' ' A' ' 182' ' ' SER . 12.9 p 34.45 47.96 0.25 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.06 -0.518 . . . . 64.12 110.873 -179.806 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 3.6 tp -105.42 -33.71 8.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.102 -0.499 . . . . 74.2 110.981 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 185' ' ' GLY . . . . . 0.436 ' HA3' ' HG3' ' A' ' 177' ' ' ARG . . . -114.39 -141.82 7.79 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.763 -0.732 . . . . 73.01 112.504 179.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 186' ' ' ILE . . . . . 0.987 HG21 HD21 ' A' ' 156' ' ' LEU . 10.5 mm -78.82 97.58 2.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.888 0.375 . . . . 73.22 111.134 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -46.57 119.5 2.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.168 -0.469 . . . . 71.31 110.838 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 188' ' ' PHE . . . . . 0.746 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 2.4 t80 -54.19 -36.46 63.45 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.474 . . . . 75.45 110.898 179.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . 0.456 HD21 ' CG ' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -67.11 -47.47 71.04 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.137 -0.483 . . . . 52.02 110.925 -179.965 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 58.3 t80 -69.07 -37.04 78.29 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.201 -0.454 . . . . 74.22 110.973 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 191' ' ' ALA . . . . . 0.579 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -72.81 -35.57 67.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.085 -0.507 . . . . 50.03 111.126 179.884 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 192' ' ' ALA . . . . . 0.679 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -56.73 -44.84 82.06 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.217 -0.447 . . . . 52.11 111.131 179.847 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 193' ' ' THR . . . . . 0.551 HG21 ' HE1' ' A' ' 224' ' ' PHE . 0.7 OUTLIER -58.65 -41.89 87.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.168 -0.469 . . . . 72.43 111.161 -179.892 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 2.6 t60 -72.83 -40.61 65.61 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.236 -0.438 . . . . 71.44 110.8 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -73.42 -47.44 41.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.181 -0.463 . . . . 71.01 111.061 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 196' ' ' LEU . . . . . 0.743 HD12 ' CD1' ' A' ' 113' ' ' LEU . 4.4 mm? -64.2 -43.42 95.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.211 -0.45 . . . . 74.51 110.942 -179.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -57.44 -28.2 59.12 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.706 -0.759 . . . . 52.23 112.473 179.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 198' ' ' HIS . . . . . . . . . . . . . 4.7 m-70 -66.5 -44.26 83.07 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.827 0.346 . . . . 75.21 110.871 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.42 -25.86 64.69 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.207 -0.451 . . . . 71.13 110.891 -179.824 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 1.5 mt -82.22 -3.07 54.33 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.161 -0.472 . . . . 64.13 110.879 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 88.96 -5.64 84.36 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.807 -0.711 . . . . 50.41 112.565 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 202' ' ' MET . . . . . 0.438 ' SD ' HD12 ' A' ' 234' ' ' ILE . 2.2 mtp -61.93 134.97 57.34 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.815 0.34 . . . . 63.21 110.907 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -101.17 177.11 27.32 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.787 -0.721 . . . . 64.44 112.494 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 17.9 m-70 -70.26 160.76 31.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.782 0.325 . . . . 74.32 110.868 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 205' ' ' SER . . . . . 0.476 ' OG ' ' HB1' ' A' ' 210' ' ' ALA . 0.0 OUTLIER -121.39 151.72 39.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.194 -0.457 . . . . 53.34 110.827 -179.768 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 2.0 p -87.73 -4.63 58.89 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.178 -0.465 . . . . 72.22 110.818 -179.834 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.83 137.9 82.63 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.646 0.736 . . . . 65.11 110.791 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 -7.61 21.49 Favored 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.641 2.227 . . . . 74.53 112.311 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -126.08 29.79 5.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.26 -0.427 . . . . 63.52 110.862 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 210' ' ' ALA . . . . . 0.476 ' HB1' ' OG ' ' A' ' 205' ' ' SER . . . -87.34 145.76 26.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.123 -0.489 . . . . 62.23 111.112 179.878 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -69.69 -28.57 37.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.185 -0.461 . . . . 62.04 111.08 -179.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 14.0 tpp -96.48 10.49 38.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.177 -0.465 . . . . 75.22 110.953 179.884 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 213' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -55.69 115.05 8.5 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.629 0.728 . . . . 73.43 110.862 -179.791 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.78 -18.11 37.12 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.661 2.24 . . . . 63.01 112.353 179.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 215' ' ' THR . . . . . 0.477 HG23 ' CG2' ' A' ' 61' ' ' ILE . 0.3 OUTLIER -84.2 52.95 2.46 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.254 -0.43 . . . . 74.24 111.165 -179.991 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 5.8 t80 . . . . . 0 C--N 1.328 -0.355 0 CA-C-N 116.163 -0.471 . . . . 74.14 110.912 -179.861 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 224' ' ' PHE . . . . . 0.551 ' HE1' HG21 ' A' ' 193' ' ' THR . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.988 0.423 . . . . 65.01 110.895 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -143.76 161.0 39.73 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.166 -0.47 . . . . 64.24 110.907 179.941 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 226' ' ' LEU . . . . . 0.768 HD11 ' O ' ' A' ' 115' ' ' MET . 36.3 mt -64.38 147.99 51.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.272 -0.422 . . . . 53.44 110.849 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 227' ' ' SER . . . . . 0.463 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 0.9 OUTLIER -87.73 150.86 23.34 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.106 -0.497 . . . . 74.21 110.832 -179.924 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 -65.08 -66.8 0.5 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.18 -0.464 . . . . 74.54 110.922 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -55.37 -26.02 38.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.208 -0.451 . . . . 72.22 110.902 179.932 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -70.37 -49.04 53.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.156 -0.474 . . . . 74.23 110.868 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 231' ' ' ILE . . . . . 0.679 HD11 ' HB3' ' A' ' 226' ' ' LEU . 9.4 mt -69.4 -44.18 80.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.263 -0.426 . . . . 73.41 111.12 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.8 -31.98 65.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.142 -0.481 . . . . 65.42 110.932 179.86 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -70.13 -46.05 52.91 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.72 -0.753 . . . . 63.43 112.48 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 234' ' ' ILE . . . . . 0.438 HD12 ' SD ' ' A' ' 202' ' ' MET . 15.1 tt -73.18 -32.94 40.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.784 0.326 . . . . 71.54 111.114 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -66.33 -24.35 66.51 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.147 -0.479 . . . . 70.33 110.954 179.904 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 236' ' ' LYS . . . . . 0.46 ' HD3' ' N ' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.04 -28.97 61.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.172 -0.467 . . . . 51.21 110.829 -179.983 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 237' ' ' LEU . . . . . 0.738 HD22 ' CD ' ' A' ' 83' ' ' LYS . 5.7 tt -97.09 -23.61 16.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.251 -0.431 . . . . 75.41 110.925 179.952 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 238' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -92.45 -35.53 13.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.17 -0.468 . . . . 51.24 110.927 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.264 0 C-N-CA 120.724 -0.75 . . . . 32.22 112.451 179.977 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' -2' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.107 0 CA-C-O 121.572 0.701 . . . . 73.02 110.964 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -1' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 167.73 23.61 Favored 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 122.704 2.269 . . . . 71.15 112.327 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -174.88 73.6 0.3 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.67 0.747 . . . . 62.13 110.936 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 -171.34 0.46 Allowed 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.67 2.247 . . . . 64.14 112.316 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -153.13 77.0 1.14 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.179 -0.464 . . . . 60.51 110.935 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -95.3 -24.37 16.79 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.147 -0.478 . . . . 74.01 110.864 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.45 -33.96 66.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 71.4 111.143 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -55.87 -32.63 59.29 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.709 -0.758 . . . . 60.51 112.501 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -108.84 21.58 27.37 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.764 -0.731 . . . . 54.22 112.496 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.33 164.28 25.68 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.774 0.321 . . . . 72.23 110.855 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 47.9 t -87.03 168.73 13.05 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.221 -0.445 . . . . 73.24 110.857 -179.8 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.41 -31.94 71.87 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.136 -0.484 . . . . 50.12 110.848 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.38 -42.84 98.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.167 -0.469 . . . . 72.33 110.973 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.8 -40.73 95.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.146 -0.479 . . . . 72.14 110.939 179.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 21.1 t-105 -73.06 -35.42 66.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.187 -0.46 . . . . 71.22 110.898 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 49.7 tt0 -73.3 -35.46 66.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.267 -0.424 . . . . 72.51 110.852 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 13.3 mt-30 -62.92 -36.83 84.67 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.206 -0.452 . . . . 61.24 110.903 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.774 ' HB1' ' HE3' ' A' ' 62' ' ' MET . . . -57.1 -35.16 69.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.202 -0.454 . . . . 54.34 111.117 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.719 ' NE2' HD12 ' A' ' 35' ' ' LEU . 0.8 OUTLIER -64.78 -42.91 94.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.149 -0.478 . . . . 73.12 110.912 -179.914 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -76.99 -31.48 56.53 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.19 -0.459 . . . . 72.4 110.87 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -60.33 -44.08 95.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.159 -0.473 . . . . 75.11 110.907 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.654 HD13 ' O ' ' A' ' 19' ' ' LEU . 3.0 tm? -71.43 -22.27 61.87 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.138 -0.483 . . . . 72.51 110.862 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.452 ' HE2' ' HA ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -72.3 -43.75 63.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.2 -0.455 . . . . 74.41 110.919 179.816 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.452 ' HA ' ' HE2' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -70.25 -27.84 64.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.445 . . . . 74.05 110.853 179.999 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -74.09 -5.72 43.33 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.21 -0.45 . . . . 74.31 110.852 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -120.75 -79.11 0.6 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.163 -0.471 . . . . 72.55 110.943 -179.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.699 ' HG ' HG23 ' A' ' 72' ' ' VAL . 18.7 mt -159.28 -176.81 6.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.133 -0.485 . . . . 75.43 110.882 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -94.48 89.65 5.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.173 -0.467 . . . . 71.41 110.92 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 56.8 m-20 -125.06 96.07 4.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.147 -0.479 . . . . 74.25 110.912 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.6 p -85.08 -6.44 59.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.213 -0.449 . . . . 62.15 110.858 -179.746 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -82.51 -21.65 35.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.144 -0.48 . . . . 74.51 110.88 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.678 HG21 ' HE2' ' A' ' 38' ' ' LYS . 4.9 m -76.9 -4.8 45.66 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.156 -0.475 . . . . 70.44 111.115 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 58.5 mttt -58.06 100.33 0.06 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.179 -0.464 . . . . 73.33 110.883 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -168.45 160.65 11.3 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.19 -0.459 . . . . 64.43 110.862 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.11 -39.69 60.41 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.147 -0.479 . . . . 70.21 111.121 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 -72.72 -40.27 66.28 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.191 -0.459 . . . . 35.31 110.858 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 59.7 m -59.53 -21.35 60.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 74.02 110.89 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.719 HD12 ' NE2' ' A' ' 16' ' ' GLN . 7.3 tt -63.74 -44.37 93.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.148 -0.478 . . . . 72.52 110.913 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.93 -51.12 65.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.136 -0.484 . . . . 73.13 110.857 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.31 -50.48 69.9 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.177 -0.465 . . . . 63.32 111.097 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.678 ' HE2' HG21 ' A' ' 29' ' ' THR . 24.4 mmmt -59.95 -49.51 77.39 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.226 -0.443 . . . . 72.32 110.896 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.905 HD11 HD22 ' A' ' 54' ' ' LEU . 0.1 OUTLIER -56.67 -36.99 70.21 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.266 -0.425 . . . . 72.11 110.894 179.917 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.5 ttmt -58.99 -45.5 90.48 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.451 . . . . 62.43 110.856 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.462 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 2.9 pt-20 -60.58 -32.84 71.92 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.247 -0.433 . . . . 75.11 110.827 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 7.2 ttt -68.47 -34.0 75.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.171 -0.468 . . . . 63.43 110.876 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.46 ' HG3' ' HA ' ' A' ' 51' ' ' THR . 2.3 mm100 -60.65 -39.98 90.33 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.215 -0.448 . . . . 74.45 110.916 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.2 mmpt? -70.58 -33.13 70.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 71.43 110.9 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 38.4 t80 -70.77 -37.33 73.36 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.232 -0.44 . . . . 73.32 110.903 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.727 ' HB3' HD23 ' A' ' 48' ' ' LEU . 2.7 m-85 -81.91 -35.63 28.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.108 -0.496 . . . . 70.43 110.869 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.447 ' HA2' ' HB3' ' A' ' 206' ' ' SER . . . 102.98 -10.2 55.41 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.742 -0.742 . . . . 64.34 112.51 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.727 HD23 ' HB3' ' A' ' 46' ' ' PHE . 0.7 OUTLIER -61.84 139.76 95.55 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.644 0.735 . . . . 64.11 110.898 -179.926 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.77 -53.23 0.28 Allowed 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.68 2.253 . . . . 74.5 112.318 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.649 HD12 HG23 ' A' ' 58' ' ' VAL . 0.9 OUTLIER -50.64 108.27 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.209 -0.451 . . . . 71.22 111.129 179.94 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.46 ' HA ' ' HG3' ' A' ' 43' ' ' GLN . 1.2 p -96.81 155.56 16.72 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.199 -0.455 . . . . 73.25 111.138 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 57.68 20.63 40.13 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.736 -0.745 . . . . 64.24 112.49 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.423 ' O ' HG11 ' A' ' 58' ' ' VAL . 2.0 mtt -99.81 158.91 15.46 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.759 0.314 . . . . 75.23 110.917 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.905 HD22 HD11 ' A' ' 39' ' ' LEU . 23.4 tp -174.63 78.54 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.287 -0.415 . . . . 73.4 110.928 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 178.8 -31.22 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.242 -0.435 . . . . 44.35 110.905 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 8.5 m -91.14 -99.81 0.11 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.159 -0.473 . . . . 75.25 110.867 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 42.6 ttt85 -84.96 -29.36 25.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.11 -0.496 . . . . 61.22 110.857 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.649 HG23 HD12 ' A' ' 50' ' ' ILE . 93.1 t -64.23 -41.61 92.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.208 -0.451 . . . . 70.12 111.117 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.606 HD12 ' CD1' ' A' ' 54' ' ' LEU . 0.1 OUTLIER -75.09 -31.72 25.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.192 -0.458 . . . . 74.43 111.11 179.938 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -63.58 -44.39 94.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.186 -0.461 . . . . 73.45 110.863 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.657 HD12 ' CE2' ' A' ' 46' ' ' PHE . 24.3 pt -67.32 -30.1 47.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 74.52 111.132 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.774 ' HE3' ' HB1' ' A' ' 15' ' ' ALA . 1.5 mmm -66.03 -36.22 82.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.159 -0.473 . . . . 74.01 110.931 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -87.74 -22.74 24.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 42.22 110.916 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 34.7 mttp -80.4 145.11 58.8 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.561 0.696 . . . . 65.34 110.888 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.81 161.08 47.31 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.689 2.259 . . . . 72.11 112.358 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.408 ' HG3' ' HA ' ' A' ' 214' ' ' PRO . 29.0 ttp180 -161.65 -82.5 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.195 -0.457 . . . . 71.51 110.903 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -145.36 156.45 43.79 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.175 -0.466 . . . . 55.3 110.878 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.652 ' HA2' HG23 ' A' ' 155' ' ' THR . . . -96.79 14.23 64.28 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.721 -0.752 . . . . 64.23 112.452 -179.862 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.696 HG12 ' HD2' ' A' ' 70' ' ' PRO . 0.0 OUTLIER -111.22 142.09 25.68 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.636 0.731 . . . . 74.23 111.098 179.996 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.696 ' HD2' HG12 ' A' ' 69' ' ' VAL . 53.7 Cg_endo -69.82 178.21 4.84 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.65 2.234 . . . . 63.44 112.367 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -107.97 -2.9 19.31 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.25 -0.432 . . . . 74.45 110.841 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.699 HG23 ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -141.83 129.74 21.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.224 -0.443 . . . . 53.43 111.166 179.989 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.553 ' HB1' ' HE1' ' A' ' 75' ' ' TYR . . . -131.08 170.43 14.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.188 -0.46 . . . . 73.13 111.142 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -179.74 96.32 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.222 -0.445 . . . . 73.31 110.894 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.553 ' HE1' ' HB1' ' A' ' 73' ' ' ALA . 6.4 p90 -150.37 84.99 1.38 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.145 -0.479 . . . . 70.41 110.943 -179.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 57.26 179.2 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.101 -0.5 . . . . 74.2 110.841 -179.841 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.9 mp -136.66 62.2 1.61 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.127 -0.488 . . . . 70.34 110.903 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . 0.476 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 1.7 m-85 -69.13 -60.75 3.93 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.669 0.747 . . . . 71.24 110.885 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.476 ' HD2' ' N ' ' A' ' 78' ' ' PHE . 53.6 Cg_endo -69.78 132.69 23.84 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.643 2.229 . . . . 73.34 112.362 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -66.49 129.2 39.03 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.185 -0.461 . . . . 74.43 110.915 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 62.88 159.63 0.12 Allowed Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.665 0.745 . . . . 70.4 110.828 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.81 -49.7 0.53 Allowed 'Trans proline' 0 C--O 1.232 0.182 0 C-N-CA 122.666 2.244 . . . . 71.11 112.309 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.703 ' CE ' HD13 ' A' ' 237' ' ' LEU . 8.5 mttp -83.31 168.43 16.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.252 -0.431 . . . . 64.45 110.913 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . 0.508 ' CD1' ' HA ' ' A' ' 200' ' ' LEU . 35.4 m95 -53.55 131.78 39.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.248 -0.433 . . . . 73.31 110.957 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.23 1.03 13.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.272 -0.422 . . . . 65.3 111.154 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.2 m -73.39 178.28 4.68 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.237 -0.438 . . . . 70.34 110.843 -179.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.81 -10.22 22.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.135 -0.484 . . . . 71.12 110.882 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -156.18 142.85 10.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.221 -0.445 . . . . 74.14 111.073 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 76.8 t -116.65 130.33 71.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.15 -0.477 . . . . 72.25 111.081 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.498 HG23 ' HB3' ' A' ' 125' ' ' ARG . 0.0 OUTLIER -118.45 144.57 45.89 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.115 -0.493 . . . . 71.01 111.124 -179.967 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 4.6 p90 -137.62 146.38 43.87 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.202 -0.454 . . . . 70.51 110.937 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 6.1 ttt180 -149.4 131.68 15.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.113 -0.494 . . . . 71.25 110.833 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.484 ' H ' HD12 ' A' ' 93' ' ' ILE . 4.8 mp -75.18 132.52 33.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.191 -0.459 . . . . 72.4 111.13 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 21.6 t -86.25 -40.25 14.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.163 -0.471 . . . . 60.2 111.112 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 92.0 p -156.42 169.34 24.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.172 -0.467 . . . . 64.24 110.818 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 11.5 p90 -125.39 154.98 41.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.126 -0.488 . . . . 72.25 110.911 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.9 t -96.59 141.14 30.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.159 -0.473 . . . . 64.11 111.097 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 2.6 mmp_? -53.06 -18.22 1.97 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 72.14 110.827 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.94 -35.92 82.71 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.196 -0.456 . . . . 74.13 110.894 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.51 HD22 HG21 ' A' ' 104' ' ' THR . 1.0 OUTLIER -141.86 153.7 64.65 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.602 0.715 . . . . 72.52 110.89 -179.987 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . 0.564 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.6 Cg_endo -69.77 151.02 68.88 Favored 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.692 2.262 . . . . 73.11 112.356 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 11.8 t-160 -52.36 -27.6 16.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.229 -0.441 . . . . 74.11 110.833 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.564 HG22 ' HB2' ' A' ' 101' ' ' PRO . 0.0 OUTLIER -75.37 -40.5 42.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.232 -0.44 . . . . 74.02 111.141 179.991 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . 0.651 ' O ' HD22 ' A' ' 108' ' ' LEU . 3.6 m -69.83 -38.42 76.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.138 -0.483 . . . . 52.11 111.184 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.797 ' O ' HG13 ' A' ' 109' ' ' VAL . 81.3 t -72.81 -45.55 56.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.173 -0.467 . . . . 71.51 111.134 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.674 ' O ' HG22 ' A' ' 109' ' ' VAL . 2.6 t0 -63.41 -42.6 98.77 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.183 -0.462 . . . . 63.44 110.829 179.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 11.2 ptm180 -70.11 -34.15 72.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.462 . . . . 75.02 110.87 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.651 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -62.08 -48.73 78.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.217 -0.447 . . . . 71.04 110.914 -179.969 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.797 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.5 m -55.4 -42.12 65.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.454 . . . . 72.31 111.114 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.469 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 48.0 t -70.22 -33.36 71.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.223 -0.444 . . . . 72.14 110.894 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.417 ' HB3' HD21 ' A' ' 189' ' ' LEU . 0.3 OUTLIER -61.84 -32.82 73.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.15 -0.477 . . . . 74.35 110.876 179.964 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -97.48 -40.31 8.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.198 -0.456 . . . . 74.32 111.059 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.843 HD12 HD12 ' A' ' 196' ' ' LEU . 0.3 OUTLIER -65.26 -33.58 76.33 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.243 -0.435 . . . . 72.0 110.88 -179.943 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 46.6 t30 -69.74 -40.55 76.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 72.34 110.9 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . 0.72 ' HB3' HD23 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -58.86 -34.56 71.75 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.206 -0.452 . . . . 54.12 110.868 179.91 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 7.8 m95 -66.45 -41.33 89.25 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.211 -0.45 . . . . 75.23 110.915 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -72.72 -38.85 56.66 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.761 -0.733 . . . . 73.32 112.471 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.0 mmpt? -62.66 -16.3 56.28 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.758 0.313 . . . . 72.42 110.921 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.619 ' HB3' HG23 ' A' ' 231' ' ' ILE . 37.2 mm-40 -100.4 13.33 34.83 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.222 -0.444 . . . . 75.24 110.892 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.8 HD12 HD12 ' A' ' 122' ' ' LEU . 6.4 pt -148.09 152.62 40.22 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.601 0.715 . . . . 71.34 111.136 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.74 1.21 4.63 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.685 2.257 . . . . 72.21 112.325 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.8 HD12 HD12 ' A' ' 120' ' ' ILE . 4.3 mt -62.63 -156.61 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.228 -0.442 . . . . 73.22 110.936 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 5.7 t60 -160.56 142.61 12.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.151 -0.477 . . . . 74.12 110.837 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 28.5 m-85 -121.59 148.52 44.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.182 -0.463 . . . . 75.54 110.849 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.498 ' HB3' HG23 ' A' ' 90' ' ' THR . 0.2 OUTLIER -126.97 141.69 51.73 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.136 -0.484 . . . . 75.14 110.93 -179.949 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.57 ' HE3' HG13 ' A' ' 128' ' ' VAL . 0.1 OUTLIER -80.63 148.61 30.18 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.235 -0.439 . . . . 72.22 110.937 179.967 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . 0.898 HG11 ' HB2' ' A' ' 132' ' ' ALA . 25.6 m -103.14 126.31 57.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.278 -0.419 . . . . 50.13 111.087 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.602 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -144.34 -11.11 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.163 -0.471 . . . . 74.43 111.081 179.945 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' TRP . . . . . 0.602 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -157.44 109.17 2.35 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.193 -0.458 . . . . 71.25 110.949 179.981 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 109.77 -162.65 12.62 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.758 -0.734 . . . . 62.11 112.485 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 9.7 p -101.96 156.06 17.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.759 0.314 . . . . 63.25 111.13 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . 0.898 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -111.77 165.39 12.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.186 -0.461 . . . . 51.34 111.098 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -71.88 -55.13 8.07 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.22 -0.445 . . . . 75.41 110.825 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . 0.436 HD12 ' N ' ' A' ' 134' ' ' ILE . 5.0 mp -95.37 108.8 21.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.251 -0.432 . . . . 70.51 111.114 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 14.2 mmm -90.76 127.75 36.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.189 -0.459 . . . . 72.43 110.941 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.42 ' O ' HG23 ' A' ' 93' ' ' ILE . 0.8 OUTLIER -106.24 95.14 3.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.263 -0.426 . . . . 70.04 111.147 179.948 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -132.06 163.52 23.88 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.753 -0.737 . . . . 63.34 112.517 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' PHE . . . . . 0.487 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 49.9 m-85 -105.22 150.03 25.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.864 0.364 . . . . 74.01 110.885 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.566 ' HB1' ' CB ' ' A' ' 143' ' ' HIS . . . 174.45 166.89 0.24 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.107 -0.497 . . . . 71.21 111.122 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.403 ' HB3' ' HB3' ' A' ' 149' ' ' PHE . 29.4 mtm180 -104.41 173.2 6.4 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.211 -0.45 . . . . 62.21 110.865 -179.883 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -57.28 -15.91 17.82 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.758 -0.734 . . . . 74.24 112.464 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -96.51 13.3 28.49 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.756 0.312 . . . . 75.03 111.039 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . 0.566 ' CB ' ' HB1' ' A' ' 139' ' ' ALA . 4.1 p80 -75.81 -5.15 44.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.245 -0.434 . . . . 71.11 110.862 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 121.37 20.41 3.28 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.741 -0.742 . . . . 45.51 112.498 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -124.76 173.31 8.66 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.843 0.354 . . . . 72.14 110.864 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 20.5 m -75.42 170.51 15.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.196 -0.456 . . . . 51.25 110.846 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 64.89 132.57 0.03 OUTLIER Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.703 0.763 . . . . 73.4 110.928 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 152.01 69.11 Favored 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.708 2.272 . . . . 74.53 112.372 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' PHE . . . . . 0.443 ' C ' ' H ' ' A' ' 151' ' ' GLY . 21.3 p90 -53.01 -41.4 64.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.243 -0.435 . . . . 63.52 110.877 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 76.19 -25.13 0.21 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.171 -0.468 . . . . 63.11 110.902 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . 0.443 ' H ' ' C ' ' A' ' 149' ' ' PHE . . . 77.07 -151.35 38.68 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.74 -0.743 . . . . 71.41 112.481 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.75 142.15 47.18 Favored 'Trans proline' 0 C--N 1.341 0.137 0 C-N-CA 122.704 2.269 . . . . 75.11 112.333 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . 0.434 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 104.15 -137.19 13.43 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.725 -0.75 . . . . 70.32 112.418 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 154' ' ' ASN . . . . . 0.434 ' C ' ' O ' ' A' ' 153' ' ' GLY . 4.1 p30 -34.53 138.09 0.11 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.955 0.407 . . . . 73.25 110.886 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 155' ' ' THR . . . . . 0.652 HG23 ' HA2' ' A' ' 68' ' ' GLY . 1.5 m 73.29 112.23 0.06 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.166 -0.47 . . . . 44.41 111.171 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . 1.042 HD21 HG21 ' A' ' 186' ' ' ILE . 0.6 OUTLIER -94.92 -53.09 3.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.244 -0.434 . . . . 75.02 110.918 179.975 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . 0.548 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -163.85 148.58 10.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.201 -0.454 . . . . 71.42 111.107 179.773 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 16.1 p-80 -106.8 124.37 49.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 72.02 110.917 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -110.48 152.39 26.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.254 -0.43 . . . . 74.42 111.108 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -105.46 151.86 23.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.231 -0.44 . . . . 75.31 110.876 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . 0.702 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -82.79 164.06 48.56 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.581 0.705 . . . . 61.04 111.111 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 162' ' ' PRO . . . . . 0.702 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.9 Cg_endo -69.79 79.17 0.97 Allowed 'Trans proline' 0 C--N 1.34 0.127 0 C-N-CA 122.661 2.241 . . . . 74.44 112.347 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -137.98 124.71 3.03 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.73 -0.748 . . . . 61.41 112.497 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 63.31 -171.1 0.17 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.797 0.332 . . . . 73.1 111.135 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -86.0 -41.32 7.17 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.74 -0.743 . . . . 74.03 112.465 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 166' ' ' LEU . . . . . 0.43 ' C ' HD23 ' A' ' 166' ' ' LEU . 10.2 tt -71.32 -37.21 71.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.837 0.351 . . . . 65.12 110.913 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -79.11 161.24 47.12 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.766 -0.731 . . . . 43.43 112.488 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 91.29 23.08 30.24 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.765 -0.731 . . . . 74.31 112.54 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -94.42 167.03 11.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.848 0.356 . . . . 63.41 110.878 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.46 130.69 55.9 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.207 -0.451 . . . . 74.21 111.105 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 24.6 m170 -126.29 158.6 35.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.225 -0.443 . . . . 72.53 110.881 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -142.99 138.83 30.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.208 -0.451 . . . . 71.44 110.85 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 59.2 t0 -69.21 97.8 0.96 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.138 -0.483 . . . . 74.11 110.887 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.41 -17.04 10.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.228 -0.442 . . . . 72.25 110.844 -179.869 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -78.97 -16.12 57.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.464 . . . . 73.32 110.824 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -80.13 -174.96 4.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.229 -0.441 . . . . 63.2 110.911 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 24.7 mtm-85 -109.41 107.23 17.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 63.14 110.877 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 68.2 m95 -108.56 137.17 46.94 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.219 -0.446 . . . . 72.31 110.945 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 179' ' ' THR . . . . . 0.508 ' HA ' HD11 ' A' ' 100' ' ' LEU . 11.1 t -178.33 163.59 1.63 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.266 -0.425 . . . . 74.13 111.14 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -125.54 -72.59 0.66 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.18 -0.464 . . . . 45.33 110.871 179.89 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -60.25 -16.16 40.83 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.702 -0.761 . . . . 62.41 112.514 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 182' ' ' SER . . . . . 0.432 ' O ' ' C ' ' A' ' 183' ' ' SER . 0.3 OUTLIER -90.62 -24.38 20.54 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.909 0.385 . . . . 64.5 110.933 -179.781 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 183' ' ' SER . . . . . 0.432 ' C ' ' O ' ' A' ' 182' ' ' SER . 91.0 p 35.61 58.17 0.87 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.087 -0.506 . . . . 64.12 110.866 -179.847 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 9.1 tt -116.75 -33.5 4.79 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.09 -0.505 . . . . 74.2 110.91 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -119.38 -139.29 5.94 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.752 -0.737 . . . . 73.01 112.488 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 186' ' ' ILE . . . . . 1.042 HG21 HD21 ' A' ' 156' ' ' LEU . 8.5 mm -79.54 100.32 4.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.882 0.372 . . . . 73.22 111.162 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -48.96 119.13 2.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.136 -0.484 . . . . 71.31 110.888 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 188' ' ' PHE . . . . . 0.589 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.2 t80 -53.72 -34.36 58.6 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.172 -0.467 . . . . 75.45 110.891 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . 0.417 HD21 ' HB3' ' A' ' 111' ' ' LYS . 0.2 OUTLIER -67.16 -48.18 68.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.15 -0.477 . . . . 52.02 110.939 -179.991 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -70.12 -37.75 75.41 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.204 -0.453 . . . . 74.22 110.912 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 191' ' ' ALA . . . . . 0.58 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -72.63 -35.47 67.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.104 -0.498 . . . . 50.03 111.138 179.883 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 192' ' ' ALA . . . . . 0.715 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -60.79 -45.09 95.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.193 -0.458 . . . . 52.11 111.121 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 193' ' ' THR . . . . . 0.771 HG21 HG21 ' A' ' 211' ' ' VAL . 11.1 m -58.76 -44.99 90.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.17 -0.468 . . . . 72.43 111.12 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 6.8 t60 -73.04 -39.79 65.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.216 -0.447 . . . . 71.44 110.857 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -71.76 -48.13 48.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.178 -0.464 . . . . 71.01 111.102 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 196' ' ' LEU . . . . . 0.843 HD12 HD12 ' A' ' 113' ' ' LEU . 4.5 mm? -62.11 -37.01 83.46 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.243 -0.435 . . . . 74.51 110.917 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -60.74 -27.69 66.91 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.762 -0.733 . . . . 52.23 112.512 179.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 198' ' ' HIS . . . . . 0.406 ' CD2' HG21 ' A' ' 69' ' ' VAL . 6.5 m-70 -67.31 -35.07 78.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.752 0.31 . . . . 75.21 110.806 -179.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -68.73 -21.46 64.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.214 -0.448 . . . . 71.13 110.855 -179.774 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 200' ' ' LEU . . . . . 0.508 ' HA ' ' CD1' ' A' ' 84' ' ' TRP . 0.5 OUTLIER -88.53 2.11 53.57 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.12 -0.491 . . . . 64.13 110.91 -179.992 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 84.04 -7.67 70.03 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.731 -0.747 . . . . 50.41 112.474 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 202' ' ' MET . . . . . 0.622 ' SD ' HD12 ' A' ' 234' ' ' ILE . 98.7 mmm -53.92 167.47 0.27 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.781 0.324 . . . . 63.21 110.868 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -137.1 161.4 25.18 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.719 -0.753 . . . . 64.44 112.512 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 13.2 m-70 -57.43 143.85 38.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.824 0.345 . . . . 74.32 110.835 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -105.92 152.52 23.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 53.34 110.897 -179.835 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 206' ' ' SER . . . . . 0.447 ' HB3' ' HA2' ' A' ' 47' ' ' GLY . 1.1 m -88.07 -4.77 58.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.156 -0.474 . . . . 72.22 110.853 -179.802 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.55 138.98 83.52 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-O 121.603 0.716 . . . . 65.11 110.865 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 -7.92 22.29 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.684 2.256 . . . . 74.53 112.36 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 -125.72 28.91 6.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.234 -0.439 . . . . 63.52 110.915 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 210' ' ' ALA . . . . . 0.436 ' O ' ' HB2' ' A' ' 213' ' ' TYR . . . -87.11 145.61 26.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.151 -0.477 . . . . 62.23 111.09 179.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 211' ' ' VAL . . . . . 0.771 HG21 HG21 ' A' ' 193' ' ' THR . 0.3 OUTLIER -73.24 -26.05 22.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.459 . . . . 62.04 111.158 179.963 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 11.3 mmm -93.78 10.07 34.56 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.138 -0.483 . . . . 75.22 110.884 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 213' ' ' TYR . . . . . 0.443 ' CD1' ' HD2' ' A' ' 214' ' ' PRO . 0.5 OUTLIER -55.54 127.54 66.45 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.669 0.747 . . . . 73.43 110.918 -179.865 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 214' ' ' PRO . . . . . 0.443 ' HD2' ' CD1' ' A' ' 213' ' ' TYR . 54.0 Cg_endo -69.75 -18.47 37.03 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.634 2.222 . . . . 63.01 112.379 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 1.2 p -90.16 32.16 0.95 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.197 -0.456 . . . . 74.24 111.129 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 6.5 t80 -51.11 123.38 9.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.175 -0.466 . . . . 74.14 110.929 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . 149.26 90.88 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.793 -0.717 . . . . 74.22 112.535 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -179.12 -170.89 0.19 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.891 0.377 . . . . 64.22 110.857 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . -53.14 105.76 0.32 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.751 -0.738 . . . . 72.24 112.505 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 220' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -102.51 101.41 19.89 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.583 0.706 . . . . 41.43 110.923 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.77 159.99 51.35 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.702 2.268 . . . . 73.42 112.322 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -71.2 -18.56 62.47 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.215 -0.448 . . . . 74.21 110.909 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -96.39 10.01 39.47 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.171 -0.468 . . . . 60.33 110.91 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -51.75 127.28 20.26 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.143 -0.48 . . . . 65.01 110.871 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.98 -164.68 1.94 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.123 -0.49 . . . . 64.24 110.883 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . 0.72 HD23 ' HB3' ' A' ' 115' ' ' MET . 1.4 mm? -59.28 148.77 30.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.255 -0.43 . . . . 53.44 110.863 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 227' ' ' SER . . . . . 0.479 ' O ' HD12 ' A' ' 231' ' ' ILE . 10.5 t -86.93 163.43 17.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.184 -0.462 . . . . 74.21 110.841 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -64.88 -62.28 1.66 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.092 -0.504 . . . . 74.54 110.889 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -55.57 -28.47 55.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.179 -0.464 . . . . 72.22 110.833 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -69.22 -48.61 61.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.181 -0.463 . . . . 74.23 110.892 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 231' ' ' ILE . . . . . 0.619 HG23 ' HB3' ' A' ' 119' ' ' GLU . 7.9 mt -68.86 -41.73 82.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.165 -0.471 . . . . 73.41 111.123 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 33.7 pttt -65.65 -32.58 74.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.193 -0.458 . . . . 65.42 110.873 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -64.88 -47.22 85.34 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.773 -0.727 . . . . 63.43 112.466 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 234' ' ' ILE . . . . . 0.622 HD12 ' SD ' ' A' ' 202' ' ' MET . 8.5 tt -72.55 -30.32 33.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.792 0.329 . . . . 71.54 111.123 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -68.73 -23.81 64.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.181 -0.463 . . . . 70.33 110.896 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 236' ' ' LYS . . . . . 0.463 ' HD3' ' N ' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.31 -27.98 60.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.168 -0.469 . . . . 51.21 110.909 179.975 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 237' ' ' LEU . . . . . 0.703 HD13 ' CE ' ' A' ' 83' ' ' LYS . 9.9 tt -95.77 -31.25 13.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.199 -0.455 . . . . 75.41 110.901 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 238' ' ' TYR . . . . . . . . . . . . . 30.7 m-85 -92.02 -35.03 14.18 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.199 -0.455 . . . . 51.24 110.953 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -128.01 -120.24 2.29 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.781 -0.724 . . . . 32.22 112.506 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.43 152.13 20.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.771 0.32 . . . . 75.42 110.917 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 5.1 ptm180 -100.85 169.58 8.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.205 -0.452 . . . . 73.34 110.914 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 3.6 m -165.78 61.24 0.11 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.22 -0.445 . . . . 62.42 110.883 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 3.1 t30 61.61 100.35 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.152 -0.476 . . . . 72.13 110.884 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 32.4 p -133.1 -170.71 2.52 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.209 -0.45 . . . . 62.23 110.857 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -125.51 -173.84 2.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.124 -0.489 . . . . 70.43 110.886 -179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.87 178.64 7.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.191 -0.459 . . . . 72.11 110.91 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 116.269 -0.423 . . . . 74.13 110.902 179.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 302' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' -2' ' ' LEU . . . . . 0.577 HD23 ' HD2' ' A' ' -1' ' ' PRO . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.108 0 CA-C-O 121.613 0.72 . . . . 73.02 110.926 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' -1' ' ' PRO . . . . . 0.577 ' HD2' HD23 ' A' ' -2' ' ' LEU . 53.5 Cg_endo -69.78 144.62 54.48 Favored 'Trans proline' 0 C--O 1.233 0.26 0 C-N-CA 122.675 2.25 . . . . 71.15 112.34 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 8.1 mt -145.3 73.7 14.26 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.601 0.715 . . . . 62.13 110.932 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.73 -172.0 0.53 Allowed 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.694 2.263 . . . . 64.14 112.369 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -150.24 72.29 1.1 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.228 -0.442 . . . . 60.51 110.898 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 26.7 mm-40 -95.07 -39.47 10.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.208 -0.451 . . . . 74.01 110.973 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.581 ' HB3' ' HB2' ' A' ' 55' ' ' ASN . . . -57.3 -33.96 68.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.159 -0.473 . . . . 71.4 111.162 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -55.88 -21.71 31.39 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.705 -0.76 . . . . 60.51 112.532 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -108.29 21.65 28.43 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.755 -0.736 . . . . 54.22 112.445 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -88.52 164.28 15.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.694 0.283 . . . . 72.23 110.895 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -82.92 168.69 16.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.231 -0.44 . . . . 73.24 110.866 -179.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -55.41 -31.99 62.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.149 -0.478 . . . . 50.12 110.904 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -63.11 -42.79 99.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.165 -0.471 . . . . 72.33 110.905 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -65.19 -40.59 94.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.238 -0.437 . . . . 72.14 110.892 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 16.2 t-105 -73.08 -33.92 65.92 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.204 -0.453 . . . . 71.22 110.898 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -67.16 -35.59 80.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.2 -0.454 . . . . 72.51 110.853 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.51 -37.61 88.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.183 -0.462 . . . . 61.24 110.908 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.1 -37.25 86.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.23 -0.441 . . . . 54.34 111.106 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -65.36 -42.85 92.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.219 -0.446 . . . . 73.12 110.85 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -76.55 -31.65 57.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.289 -0.414 . . . . 72.4 110.855 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -60.36 -43.65 96.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.213 -0.449 . . . . 75.11 110.934 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.617 HD22 ' CE2' ' A' ' 23' ' ' TYR . 0.8 OUTLIER -71.4 -21.24 62.02 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.15 -0.477 . . . . 72.51 110.93 179.89 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -71.55 -48.24 49.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.221 -0.445 . . . . 74.41 110.852 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.83 -28.53 69.92 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.258 -0.428 . . . . 74.05 110.883 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -62.59 -25.26 67.99 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.18 -0.464 . . . . 74.31 110.861 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.617 ' CE2' HD22 ' A' ' 19' ' ' LEU . 5.4 m-85 -120.66 50.11 1.37 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.125 -0.489 . . . . 72.55 110.937 -179.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.7 mt 56.97 -169.39 0.1 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.076 -0.511 . . . . 75.43 110.929 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -98.82 90.05 4.54 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.158 -0.474 . . . . 71.41 110.942 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -114.56 124.89 53.01 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.08 -0.509 . . . . 74.25 110.88 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 82.5 p -85.11 -6.32 59.31 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.252 -0.431 . . . . 62.15 110.854 -179.767 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -64.18 -14.37 54.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.155 -0.475 . . . . 74.51 110.858 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.553 HG23 ' CD ' ' A' ' 38' ' ' LYS . 0.2 OUTLIER -86.79 9.47 18.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.139 -0.482 . . . . 70.44 111.155 -179.844 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 7.4 tttm -51.45 170.09 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.165 -0.47 . . . . 73.33 110.911 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 67.06 139.87 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.261 -0.427 . . . . 64.43 110.907 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.424 ' O ' HD23 ' A' ' 35' ' ' LEU . . . -75.02 -32.14 61.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.13 -0.487 . . . . 70.21 111.028 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -59.41 -18.93 43.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.273 -0.421 . . . . 35.31 110.847 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 51.3 p -85.37 -21.61 28.78 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.162 -0.472 . . . . 74.02 110.91 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.503 ' O ' HD13 ' A' ' 39' ' ' LEU . 1.0 OUTLIER -57.84 -35.67 71.23 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.122 -0.49 . . . . 72.52 110.903 -179.991 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.1 -51.67 62.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.26 -0.427 . . . . 73.13 110.841 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.74 -44.13 86.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.47 . . . . 63.32 111.165 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.553 ' CD ' HG23 ' A' ' 29' ' ' THR . 0.0 OUTLIER -59.99 -38.3 82.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.208 -0.451 . . . . 72.32 110.844 179.994 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.503 HD13 ' O ' ' A' ' 35' ' ' LEU . 4.6 mp -67.45 -35.49 79.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.232 -0.44 . . . . 72.11 110.956 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.46 -45.93 87.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 62.43 110.899 179.863 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.54 ' HG3' ' N ' ' A' ' 42' ' ' MET . 0.0 OUTLIER -60.34 -31.92 70.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 75.11 110.943 179.902 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.553 ' SD ' HD11 ' A' ' 19' ' ' LEU . 1.4 ttt -68.27 -34.23 75.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.098 -0.501 . . . . 63.43 110.904 179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.434 HE22 HG21 ' A' ' 58' ' ' VAL . 1.5 mm-40 -62.22 -39.48 92.95 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.242 -0.435 . . . . 74.45 110.911 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.1 mmpt? -68.59 -27.33 65.96 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.209 -0.45 . . . . 71.43 110.908 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 34.4 t80 -69.79 -45.63 67.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.225 -0.443 . . . . 73.32 110.898 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.807 ' CZ ' HD13 ' A' ' 61' ' ' ILE . 8.5 m-85 -82.83 -34.52 26.86 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.096 -0.502 . . . . 70.43 110.907 -179.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 100.13 -3.05 56.77 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.719 -0.753 . . . . 64.34 112.486 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.553 HD23 ' CB ' ' A' ' 46' ' ' PHE . 0.5 OUTLIER -59.86 142.17 88.79 Favored Pre-proline 0 C--N 1.328 -0.356 0 CA-C-O 121.616 0.722 . . . . 64.11 110.856 -179.847 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.77 -52.55 0.32 Allowed 'Trans proline' 0 C--N 1.342 0.219 0 C-N-CA 122.706 2.271 . . . . 74.5 112.314 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.607 HD12 HG23 ' A' ' 58' ' ' VAL . 0.8 OUTLIER -52.67 108.24 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.262 -0.427 . . . . 71.22 111.128 179.953 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.405 ' HA ' ' HG3' ' A' ' 43' ' ' GLN . 1.5 t -108.58 158.5 17.51 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.214 -0.448 . . . . 73.25 111.153 179.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 58.61 18.06 36.41 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.722 -0.752 . . . . 64.24 112.545 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 1.9 mmm -118.95 161.14 20.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.799 0.333 . . . . 75.23 110.902 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.418 ' HA ' ' HB ' ' A' ' 58' ' ' VAL . 53.2 tp -157.64 83.87 0.89 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.273 -0.421 . . . . 73.4 110.961 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.581 ' HB2' ' HB3' ' A' ' 4' ' ' ALA . 1.0 OUTLIER -179.59 -31.9 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.173 -0.467 . . . . 44.35 110.859 179.951 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . 0.419 ' HB3' HD13 ' A' ' 50' ' ' ILE . 28.9 t -80.12 -101.3 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.211 -0.449 . . . . 75.25 110.832 -179.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.43 ' HB3' HD11 ' A' ' 50' ' ' ILE . 0.1 OUTLIER -84.89 -28.15 26.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 61.22 110.924 -179.992 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.607 HG23 HD12 ' A' ' 50' ' ' ILE . 90.5 t -59.52 -43.35 90.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.188 -0.46 . . . . 70.12 111.066 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.412 HG12 HD12 ' A' ' 54' ' ' LEU . 3.9 mm -75.13 -31.36 24.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.199 -0.455 . . . . 74.43 111.105 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -59.56 -44.08 93.38 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 73.45 110.923 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.807 HD13 ' CZ ' ' A' ' 46' ' ' PHE . 1.6 pp -74.57 -29.25 23.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.18 -0.464 . . . . 74.52 111.157 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -57.95 -41.25 82.42 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.194 -0.457 . . . . 74.01 110.903 179.794 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -89.33 -24.47 21.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.26 -0.427 . . . . 42.22 110.888 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 10.2 mttm -85.22 120.05 72.99 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.594 0.711 . . . . 65.34 110.894 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.73 151.63 69.25 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.686 2.258 . . . . 72.11 112.36 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.76 -64.2 0.22 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.176 -0.465 . . . . 71.51 110.825 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 13.9 p -145.04 149.6 35.39 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.237 -0.438 . . . . 55.3 110.885 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.536 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -104.72 18.26 44.21 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.733 -0.746 . . . . 64.23 112.456 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.615 HG21 ' CD2' ' A' ' 198' ' ' HIS . 0.6 OUTLIER -96.16 135.54 22.6 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.576 0.703 . . . . 74.23 111.175 179.982 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.5 ' HD2' HG12 ' A' ' 69' ' ' VAL . 52.9 Cg_endo -69.87 143.06 49.1 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.677 2.251 . . . . 63.44 112.268 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -100.2 26.49 6.46 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.164 -0.471 . . . . 74.45 110.858 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -130.5 129.41 64.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.176 -0.466 . . . . 53.43 111.152 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -131.01 170.55 14.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.183 -0.462 . . . . 73.13 111.146 179.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -145.29 105.97 4.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.24 -0.436 . . . . 73.31 110.883 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 28.6 m-85 -51.74 129.32 25.98 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.195 -0.457 . . . . 70.41 110.871 -179.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -179.62 100.58 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.058 -0.519 . . . . 74.2 110.895 -179.87 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 55.95 21.9 5.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.127 -0.488 . . . . 70.34 110.932 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 32.0 p90 -49.78 153.39 2.15 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.65 0.738 . . . . 71.24 110.878 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.82 126.8 13.69 Favored 'Trans proline' 0 C--N 1.343 0.238 0 C-N-CA 122.636 2.224 . . . . 73.34 112.304 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -50.93 127.31 18.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.195 -0.457 . . . . 74.43 110.842 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . 0.415 ' HA ' ' HD2' ' A' ' 82' ' ' PRO . 0.7 OUTLIER 63.06 104.42 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.674 0.749 . . . . 70.4 110.841 -179.904 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.473 ' HG2' ' H ' ' A' ' 83' ' ' LYS . 53.8 Cg_endo -69.69 -72.13 0.02 OUTLIER 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.694 2.263 . . . . 71.11 112.368 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.801 ' HD2' HD22 ' A' ' 237' ' ' LEU . 4.4 mttp -45.13 141.86 2.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.199 -0.455 . . . . 64.45 110.914 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . 0.67 ' CE3' HG21 ' A' ' 89' ' ' VAL . 40.5 m0 -47.05 109.87 0.24 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.223 -0.444 . . . . 73.31 110.907 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -114.09 -6.98 13.09 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.288 -0.414 . . . . 65.3 111.146 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -58.18 168.64 0.99 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.209 -0.45 . . . . 70.34 110.883 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 18.7 mttp -73.96 -30.55 62.59 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.095 -0.502 . . . . 71.12 110.942 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -159.84 144.93 6.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.215 -0.448 . . . . 74.14 111.17 179.841 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.67 HG21 ' CE3' ' A' ' 84' ' ' TRP . 13.0 t -126.2 140.96 47.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.194 -0.457 . . . . 72.25 111.082 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 76.8 p -122.38 166.52 14.58 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.172 -0.467 . . . . 71.01 111.17 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.407 ' HB3' ' HB ' ' A' ' 134' ' ' ILE . 3.9 p90 -151.42 146.29 25.85 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.261 -0.427 . . . . 70.51 110.915 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 17.2 ttt180 -146.33 137.42 24.4 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.139 -0.482 . . . . 71.25 110.952 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.424 ' N ' HD12 ' A' ' 93' ' ' ILE . 3.5 mp -75.0 135.44 27.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.182 -0.463 . . . . 72.4 111.144 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.449 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 21.8 t -89.25 -40.63 13.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.225 -0.443 . . . . 60.2 111.114 179.846 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 1.7 t -143.74 161.83 37.59 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.197 -0.456 . . . . 64.24 110.861 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 11.8 p90 -110.19 153.25 25.03 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.129 -0.487 . . . . 72.25 110.901 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.493 ' OG1' HG21 ' A' ' 105' ' ' VAL . 0.2 OUTLIER -82.61 140.94 32.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.139 -0.482 . . . . 64.11 111.112 -179.966 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 6.5 ppt_? -73.67 -7.66 52.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.276 -0.42 . . . . 72.14 110.863 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -96.57 -25.98 15.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.194 -0.457 . . . . 74.13 110.869 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.612 HD21 ' HA ' ' A' ' 179' ' ' THR . 0.6 OUTLIER -133.64 153.73 80.32 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.599 0.714 . . . . 72.52 110.914 -179.959 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . 0.606 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.9 Cg_endo -69.69 150.91 69.24 Favored 'Trans proline' 0 C--O 1.231 0.151 0 C-N-CA 122.723 2.282 . . . . 73.11 112.318 179.902 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 16.3 t-160 -53.35 -25.57 15.73 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.233 -0.44 . . . . 74.11 110.83 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.606 HG22 ' HB2' ' A' ' 101' ' ' PRO . 13.2 tt -76.58 -38.74 31.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.231 -0.441 . . . . 74.02 111.134 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . 0.655 ' O ' HD22 ' A' ' 108' ' ' LEU . 3.1 m -69.21 -39.94 78.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.197 -0.456 . . . . 52.11 111.197 179.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.717 ' O ' HG13 ' A' ' 109' ' ' VAL . 91.6 t -72.7 -45.95 55.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 71.51 111.169 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.674 ' O ' HG22 ' A' ' 109' ' ' VAL . 4.8 t0 -63.41 -43.33 97.81 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.108 -0.496 . . . . 63.44 110.831 179.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -70.16 -33.63 72.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.139 -0.482 . . . . 75.02 110.825 -179.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.655 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -60.7 -48.72 80.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.216 -0.447 . . . . 71.04 110.937 -179.989 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.717 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.5 m -55.28 -41.58 62.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.263 -0.426 . . . . 72.31 111.132 179.836 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.461 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 42.9 t -70.13 -33.43 71.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 72.14 110.906 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.428 ' HB3' HD21 ' A' ' 189' ' ' LEU . 0.4 OUTLIER -61.93 -32.92 73.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.081 -0.509 . . . . 74.35 110.875 179.971 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.69 -40.91 8.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.239 -0.437 . . . . 74.32 111.13 179.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.76 HD12 HD12 ' A' ' 196' ' ' LEU . 0.4 OUTLIER -65.69 -34.12 77.46 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.199 -0.455 . . . . 72.0 110.971 179.944 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -69.36 -35.11 75.53 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.199 -0.455 . . . . 72.34 110.904 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . 0.4 ' O ' HD11 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -67.07 -34.98 78.84 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.181 -0.463 . . . . 54.12 110.963 179.857 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 6.8 m95 -64.47 -49.18 72.41 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.216 -0.447 . . . . 75.23 110.92 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . 0.409 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -71.84 -29.86 66.7 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.703 -0.761 . . . . 73.32 112.479 -179.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.2 mtmt -61.36 -17.71 55.24 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.817 0.342 . . . . 72.42 110.923 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.797 ' HB3' HG23 ' A' ' 231' ' ' ILE . 18.7 mm-40 -97.96 13.26 31.4 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.124 -0.489 . . . . 75.24 110.901 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.903 HD12 HD12 ' A' ' 122' ' ' LEU . 3.3 pt -148.28 144.96 19.37 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.631 0.729 . . . . 71.34 111.096 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.69 28.17 0.18 Allowed 'Trans proline' 0 C--O 1.232 0.206 0 C-N-CA 122.72 2.28 . . . . 72.21 112.316 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.903 HD12 HD12 ' A' ' 120' ' ' ILE . 10.3 mt -76.83 -160.25 0.15 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.275 -0.42 . . . . 73.22 110.911 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -153.49 120.95 5.88 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.165 -0.47 . . . . 74.12 110.831 179.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 9.3 m-30 -110.31 142.74 41.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.189 -0.46 . . . . 75.54 110.838 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -123.84 141.23 52.22 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.123 -0.49 . . . . 75.14 110.857 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.14 157.79 25.19 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.188 -0.46 . . . . 72.22 110.894 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . 0.857 HG11 ' HB2' ' A' ' 132' ' ' ALA . 25.2 m -103.15 126.32 57.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.208 -0.451 . . . . 50.13 111.149 179.816 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.599 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -145.82 -10.77 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.227 -0.442 . . . . 74.43 111.164 179.878 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' TRP . . . . . 0.599 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -156.57 109.18 2.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.177 -0.465 . . . . 71.25 110.888 179.991 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 105.28 -163.34 14.24 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.754 -0.736 . . . . 62.11 112.471 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -101.88 156.42 17.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.792 0.329 . . . . 63.25 111.101 -179.836 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . 0.857 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -111.41 165.27 12.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.16 -0.473 . . . . 51.34 111.127 179.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -76.74 -53.69 7.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.269 -0.423 . . . . 75.41 110.918 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . 0.644 HD12 ' N ' ' A' ' 134' ' ' ILE . 1.9 mp -89.92 107.76 18.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.21 -0.45 . . . . 70.51 111.085 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . 0.449 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 22.0 mmm -95.79 130.94 42.57 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.15 -0.477 . . . . 72.43 110.878 179.814 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.533 ' CD1' HG22 ' A' ' 134' ' ' ILE . 0.3 OUTLIER -111.22 90.29 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.186 -0.461 . . . . 70.04 111.113 179.964 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . 0.415 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -130.02 167.46 21.72 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.769 -0.729 . . . . 63.34 112.522 179.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' PHE . . . . . 0.448 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 46.8 m-85 -105.49 150.88 24.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.9 0.381 . . . . 74.01 110.908 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.574 ' HB1' ' CB ' ' A' ' 143' ' ' HIS . . . 177.01 167.42 0.54 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.179 -0.464 . . . . 71.21 111.13 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 6.7 mtp180 -103.94 173.09 6.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.172 -0.467 . . . . 62.21 110.913 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -57.91 -15.55 20.89 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.73 -0.747 . . . . 74.24 112.506 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -98.74 13.32 32.68 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.831 0.348 . . . . 75.03 111.104 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . 0.574 ' CB ' ' HB1' ' A' ' 139' ' ' ALA . 6.2 p80 -71.48 -9.36 58.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.242 -0.435 . . . . 71.11 110.871 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 118.99 49.84 0.32 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.748 -0.739 . . . . 45.51 112.461 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -170.23 -176.78 2.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.767 0.318 . . . . 72.14 110.877 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -76.19 -179.74 5.21 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.259 -0.428 . . . . 51.25 110.903 -179.787 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' TYR . . . . . 0.43 ' HA ' ' HD2' ' A' ' 148' ' ' PRO . 0.2 OUTLIER 65.01 107.31 0.03 OUTLIER Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 121.656 0.741 . . . . 73.4 110.863 -179.922 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . 0.43 ' HD2' ' HA ' ' A' ' 147' ' ' TYR . 53.8 Cg_endo -69.76 151.9 69.19 Favored 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.689 2.259 . . . . 74.53 112.334 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 149' ' ' PHE . . . . . 0.419 ' O ' ' CG ' ' A' ' 150' ' ' ASP . 0.4 OUTLIER -53.43 -25.51 16.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.242 -0.435 . . . . 63.52 110.89 179.98 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . 0.419 ' CG ' ' O ' ' A' ' 149' ' ' PHE . 2.0 p30 45.38 24.44 0.16 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.151 -0.477 . . . . 63.11 110.821 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 42.62 -160.52 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.743 -0.741 . . . . 71.41 112.511 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 144.55 54.38 Favored 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.701 2.267 . . . . 75.11 112.312 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . 0.457 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 105.97 -133.87 11.82 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.673 -0.775 . . . . 70.32 112.471 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 154' ' ' ASN . . . . . 0.457 ' C ' ' O ' ' A' ' 153' ' ' GLY . 3.3 p30 -33.67 136.64 0.11 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.906 0.384 . . . . 73.25 110.883 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 155' ' ' THR . . . . . 0.497 HG23 ' HA2' ' A' ' 68' ' ' GLY . 0.3 OUTLIER 75.35 107.77 0.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.124 -0.489 . . . . 44.41 111.132 -179.997 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . 1.043 HD21 HG21 ' A' ' 186' ' ' ILE . 0.7 OUTLIER -91.86 -55.21 3.55 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.258 -0.428 . . . . 75.02 110.949 179.924 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . 0.562 ' HB1' ' O ' ' A' ' 171' ' ' HIS . . . -158.76 148.88 19.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.198 -0.456 . . . . 71.42 111.136 179.758 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 26.1 p-80 -110.41 122.59 48.07 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.262 -0.426 . . . . 72.02 110.88 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.486 ' H ' HG22 ' A' ' 69' ' ' VAL . . . -110.52 161.1 16.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.231 -0.441 . . . . 74.42 111.075 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 18.9 m-30 -112.3 134.72 53.68 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.254 -0.43 . . . . 75.31 110.897 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . 0.639 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -63.97 162.73 27.81 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.53 0.681 . . . . 61.04 111.091 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 162' ' ' PRO . . . . . 0.639 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 54.4 Cg_endo -69.73 71.59 1.49 Allowed 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.687 2.258 . . . . 74.44 112.366 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -136.08 110.1 0.78 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.776 -0.726 . . . . 61.41 112.537 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 67.1 165.93 0.22 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.89 0.376 . . . . 73.1 111.1 -179.839 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -54.72 -35.7 58.17 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.701 -0.762 . . . . 74.03 112.489 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.84 -19.53 63.46 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.896 0.379 . . . . 65.12 110.938 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -88.47 167.0 35.06 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.718 -0.753 . . . . 43.43 112.479 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 168' ' ' GLY . . . . . 0.427 ' O ' HG13 ' A' ' 134' ' ' ILE . . . 80.47 -1.95 79.91 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.81 -0.71 . . . . 74.31 112.482 -179.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -70.57 148.3 48.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.846 0.355 . . . . 63.41 110.835 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.3 130.16 56.04 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.215 -0.448 . . . . 74.21 111.047 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 171' ' ' HIS . . . . . 0.562 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 26.5 m170 -129.69 132.18 46.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.224 -0.444 . . . . 72.53 110.885 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -114.23 138.94 49.83 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.235 -0.439 . . . . 71.44 110.849 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 57.8 t0 -70.63 97.82 1.4 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.157 -0.474 . . . . 74.11 110.877 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.92 -16.69 7.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.222 -0.445 . . . . 72.25 110.933 -179.904 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -78.39 -16.16 57.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.168 -0.469 . . . . 73.32 110.851 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -84.94 -173.54 4.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.21 -0.45 . . . . 63.2 110.885 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 45.6 mtt85 -111.75 109.73 19.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.142 -0.481 . . . . 63.14 110.872 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 70.7 m95 -109.75 138.27 46.36 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.199 -0.455 . . . . 72.31 110.884 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 179' ' ' THR . . . . . 0.612 ' HA ' HD21 ' A' ' 100' ' ' LEU . 11.4 t -177.76 163.54 1.86 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.279 -0.419 . . . . 74.13 111.165 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -127.29 -72.04 0.65 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.204 -0.453 . . . . 45.33 110.826 179.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -58.67 -16.94 32.21 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.668 -0.777 . . . . 62.41 112.5 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 182' ' ' SER . . . . . 0.411 ' O ' ' C ' ' A' ' 183' ' ' SER . 1.2 m -92.56 -24.32 18.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.853 0.359 . . . . 64.5 110.846 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 183' ' ' SER . . . . . 0.411 ' C ' ' O ' ' A' ' 182' ' ' SER . 4.5 p 37.36 51.82 1.18 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.187 -0.46 . . . . 64.12 110.832 -179.802 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 41.8 tp -109.18 -33.44 6.87 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.112 -0.495 . . . . 74.2 110.947 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -118.74 -138.51 5.87 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.686 -0.769 . . . . 73.01 112.401 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 186' ' ' ILE . . . . . 1.043 HG21 HD21 ' A' ' 156' ' ' LEU . 8.2 mm -79.39 101.76 4.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.908 0.385 . . . . 73.22 111.165 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -49.38 119.18 3.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.162 -0.472 . . . . 71.31 110.895 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 188' ' ' PHE . . . . . 0.586 ' HD2' ' HB3' ' A' ' 108' ' ' LEU . 1.0 OUTLIER -53.99 -33.03 55.92 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.194 -0.457 . . . . 75.45 110.87 -179.99 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . 0.428 HD21 ' HB3' ' A' ' 111' ' ' LYS . 0.2 OUTLIER -67.24 -48.25 68.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.11 -0.495 . . . . 52.02 110.913 -179.945 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 23.0 t80 -70.4 -37.01 74.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.234 -0.439 . . . . 74.22 110.891 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 191' ' ' ALA . . . . . 0.473 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -72.65 -36.9 68.07 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.148 -0.478 . . . . 50.03 111.107 179.878 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 192' ' ' ALA . . . . . 0.704 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -57.9 -45.08 87.02 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.209 -0.45 . . . . 52.11 111.159 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 193' ' ' THR . . . . . 0.415 HG21 HG21 ' A' ' 211' ' ' VAL . 0.2 OUTLIER -59.58 -43.13 93.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.193 -0.458 . . . . 72.43 111.177 -179.975 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 4.9 t60 -72.59 -38.23 67.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.3 -0.409 . . . . 71.44 110.902 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -75.17 -47.36 28.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.235 -0.439 . . . . 71.01 111.108 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 196' ' ' LEU . . . . . 0.76 HD12 HD12 ' A' ' 113' ' ' LEU . 4.5 mm? -64.6 -43.72 92.87 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.27 -0.423 . . . . 74.51 110.908 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -57.4 -27.98 58.75 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.679 -0.772 . . . . 52.23 112.485 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 198' ' ' HIS . . . . . 0.615 ' CD2' HG21 ' A' ' 69' ' ' VAL . 4.8 m-70 -66.79 -43.88 82.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.764 0.316 . . . . 75.21 110.818 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.21 -21.83 64.2 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 71.13 110.837 -179.8 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 200' ' ' LEU . . . . . 0.433 ' O ' ' HA ' ' A' ' 83' ' ' LYS . 4.3 mt -84.68 -0.93 55.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.142 -0.481 . . . . 64.13 110.97 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 83.48 -3.97 83.23 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.721 -0.752 . . . . 50.41 112.501 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 202' ' ' MET . . . . . 0.59 ' SD ' HD12 ' A' ' 234' ' ' ILE . 99.6 mmm -51.79 172.79 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.855 0.359 . . . . 63.21 110.853 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -132.73 160.17 23.71 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.746 -0.74 . . . . 64.44 112.433 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 22.6 m-70 -61.53 161.73 9.21 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.786 0.327 . . . . 74.32 110.852 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -125.05 147.49 48.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.213 -0.448 . . . . 53.34 110.846 -179.786 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 8.3 p -87.92 -3.93 58.88 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.153 -0.476 . . . . 72.22 110.877 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -70.93 137.77 85.11 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.659 0.742 . . . . 65.11 110.823 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -69.85 -6.23 18.14 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.693 2.262 . . . . 74.53 112.277 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -130.9 29.26 4.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.279 -0.419 . . . . 63.52 110.842 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 210' ' ' ALA . . . . . 0.45 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.43 145.65 26.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.277 -0.42 . . . . 62.23 111.134 179.912 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 211' ' ' VAL . . . . . 0.415 HG21 HG21 ' A' ' 193' ' ' THR . 0.4 OUTLIER -66.91 -27.6 40.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.247 -0.433 . . . . 62.04 111.157 179.986 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 7.4 tpp -96.33 7.98 45.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.185 -0.461 . . . . 75.22 110.844 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 213' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -55.5 110.29 2.15 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.651 0.738 . . . . 73.43 110.962 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.69 -18.54 37.26 Favored 'Trans proline' 0 C--O 1.231 0.158 0 C-N-CA 122.747 2.298 . . . . 63.01 112.356 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 215' ' ' THR . . . . . 0.454 HG23 ' CG2' ' A' ' 61' ' ' ILE . 0.2 OUTLIER -84.24 55.71 3.45 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.224 -0.444 . . . . 74.24 111.152 -179.968 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 6.0 t80 -70.76 124.91 25.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 74.14 110.936 -179.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -91.7 -155.25 31.59 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.73 -0.748 . . . . 74.22 112.504 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -91.46 176.9 6.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.921 0.391 . . . . 64.22 110.867 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . 64.7 154.77 0.14 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.776 -0.726 . . . . 72.24 112.52 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 220' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -120.13 148.76 47.77 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-O 121.578 0.704 . . . . 41.43 110.884 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.85 168.66 21.03 Favored 'Trans proline' 0 C--N 1.341 0.147 0 C-N-CA 122.693 2.262 . . . . 73.42 112.302 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.93 -45.08 17.27 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.212 -0.449 . . . . 74.21 110.894 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -129.43 -40.13 1.45 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.201 -0.454 . . . . 60.33 110.9 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 224' ' ' PHE . . . . . 0.4 ' HZ ' ' HG1' ' A' ' 193' ' ' THR . 0.4 OUTLIER 64.03 137.48 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.199 -0.455 . . . . 65.01 110.927 -179.955 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -143.65 167.14 22.96 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.125 -0.489 . . . . 64.24 110.913 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . 0.699 HD13 ' HG3' ' A' ' 119' ' ' GLU . 0.4 OUTLIER -59.79 149.52 30.87 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.223 -0.444 . . . . 53.44 110.96 179.88 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 227' ' ' SER . . . . . 0.464 ' O ' HD12 ' A' ' 231' ' ' ILE . 5.9 t -86.88 158.6 19.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.236 -0.438 . . . . 74.21 110.85 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -65.4 -65.1 0.72 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.129 -0.487 . . . . 74.54 110.933 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -55.42 -26.34 41.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.196 -0.456 . . . . 72.22 110.822 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 230' ' ' ASP . . . . . 0.424 ' HB2' ' HB3' ' A' ' 227' ' ' SER . 33.1 t70 -69.34 -48.4 61.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.231 -0.44 . . . . 74.23 110.872 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 231' ' ' ILE . . . . . 0.797 HG23 ' HB3' ' A' ' 119' ' ' GLU . 8.7 mt -68.49 -42.94 84.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.193 -0.458 . . . . 73.41 111.118 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 7.4 pttt -63.86 -32.38 73.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.137 -0.483 . . . . 65.42 110.85 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -62.95 -49.76 69.51 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.708 -0.758 . . . . 63.43 112.446 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 234' ' ' ILE . . . . . 0.59 HD12 ' SD ' ' A' ' 202' ' ' MET . 9.1 tt -72.97 -31.99 37.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.831 0.348 . . . . 71.54 111.187 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 11.5 mt-30 -70.9 -23.64 62.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.142 -0.481 . . . . 70.33 110.882 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 236' ' ' LYS . . . . . 0.422 ' HE2' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -73.77 -28.46 61.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.175 -0.466 . . . . 51.21 110.865 179.963 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 237' ' ' LEU . . . . . 0.801 HD22 ' HD2' ' A' ' 83' ' ' LYS . 8.4 tt -97.98 -26.5 14.62 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.263 -0.426 . . . . 75.41 110.935 179.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 238' ' ' TYR . . . . . 0.446 ' CE1' HD11 ' A' ' 122' ' ' LEU . 15.1 m-85 -92.3 -35.28 13.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.465 . . . . 51.24 110.918 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -141.43 -119.61 1.56 Allowed Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.708 -0.758 . . . . 32.22 112.481 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 7.6 ttpp -86.07 148.71 25.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.711 0.291 . . . . 75.42 110.913 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 1.5 ptt180 -95.56 -169.55 1.98 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.278 -0.419 . . . . 73.34 110.924 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 2.9 p -178.85 38.01 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.264 -0.425 . . . . 62.42 110.852 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 1.9 t30 63.2 97.38 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.158 -0.474 . . . . 72.13 110.901 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 12.6 t -143.6 -179.85 6.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.143 -0.48 . . . . 62.23 110.832 -179.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 7.1 ptp85 -134.23 -170.04 2.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.16 -0.473 . . . . 70.43 110.919 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 5.2 ttpt -146.76 76.35 1.43 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 72.11 110.94 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 116.217 -0.447 . . . . 74.13 110.93 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 302' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' -2' ' ' LEU . . . . . . . . . . . . . 2.4 mp . . . . . 0 C--O 1.231 0.122 0 CA-C-O 121.584 0.707 . . . . 73.02 110.924 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' -1' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.71 155.68 65.46 Favored 'Trans proline' 0 C--O 1.233 0.262 0 C-N-CA 122.645 2.23 . . . . 71.15 112.381 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 0' ' ' LEU . . . . . 0.472 ' CB ' ' CD ' ' A' ' 1' ' ' PRO . 0.3 OUTLIER 179.8 -61.04 0.0 OUTLIER Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.612 0.72 . . . . 62.13 110.885 179.988 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.472 ' CD ' ' CB ' ' A' ' 0' ' ' LEU . 54.0 Cg_endo -69.72 171.15 14.94 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.754 2.303 . . . . 64.14 112.348 179.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -158.55 36.91 0.23 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.229 -0.441 . . . . 60.51 110.954 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -67.38 -23.36 65.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.192 -0.458 . . . . 74.01 110.861 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.36 -34.0 66.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.175 -0.466 . . . . 71.4 111.127 179.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -58.32 -21.55 48.14 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.701 -0.761 . . . . 60.51 112.474 -179.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -108.93 21.51 27.28 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.688 -0.767 . . . . 54.22 112.463 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 31.1 mtt -75.23 164.19 26.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.814 0.34 . . . . 72.23 110.879 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -83.88 168.6 15.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.216 -0.447 . . . . 73.24 110.863 -179.854 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -62.44 -32.03 72.83 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.082 -0.508 . . . . 50.12 110.944 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.96 -42.82 80.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.156 -0.475 . . . . 72.33 110.887 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.41 -39.18 78.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.167 -0.47 . . . . 72.14 110.886 179.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 22.1 t-105 -72.04 -40.38 68.43 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.23 -0.441 . . . . 71.22 110.912 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 71.6 tt0 -73.12 -36.95 66.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.264 -0.425 . . . . 72.51 110.932 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -65.0 -38.42 90.9 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 61.24 110.909 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.27 -39.05 74.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.13 -0.486 . . . . 54.34 111.116 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.421 HE22 HD22 ' A' ' 35' ' ' LEU . 3.3 mt-30 -69.74 -43.0 73.21 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.174 -0.466 . . . . 73.12 110.905 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -66.42 -31.36 72.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.2 -0.454 . . . . 72.4 110.846 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -61.22 -36.27 79.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.168 -0.469 . . . . 75.11 110.934 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.721 HD12 ' HG2' ' A' ' 38' ' ' LYS . 3.1 tm? -71.88 -21.02 61.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.06 -0.518 . . . . 72.51 110.868 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 4.2 ptmt -75.06 -28.84 60.52 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.235 -0.438 . . . . 74.41 110.841 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.7 ptp180 -86.35 -28.11 23.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.295 -0.412 . . . . 74.05 110.851 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -65.05 -18.15 65.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.18 -0.464 . . . . 74.31 110.895 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.601 ' HB3' HG21 ' A' ' 72' ' ' VAL . 7.6 m-85 -120.59 50.47 1.32 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.169 -0.469 . . . . 72.55 110.869 -179.788 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.706 ' HG ' HG23 ' A' ' 72' ' ' VAL . 4.0 mt 67.64 -169.05 0.19 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.144 -0.48 . . . . 75.43 110.929 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -100.71 92.06 4.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.178 -0.464 . . . . 71.41 110.897 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -117.09 94.82 4.72 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.154 -0.475 . . . . 74.25 110.809 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.5 p -85.0 -17.55 37.21 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.148 -0.478 . . . . 62.15 110.883 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -58.49 -23.33 57.61 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.139 -0.482 . . . . 74.51 110.866 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.0 m -88.76 9.44 24.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.169 -0.469 . . . . 70.44 111.153 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 4.5 ttmm -58.66 115.84 3.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.202 -0.454 . . . . 73.33 110.907 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -178.93 152.55 0.59 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.185 -0.461 . . . . 64.43 110.843 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.698 ' O ' HD23 ' A' ' 35' ' ' LEU . . . -75.15 -40.17 59.84 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.12 -0.491 . . . . 70.21 111.061 179.875 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -84.15 -18.66 35.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.243 -0.435 . . . . 35.31 110.898 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.4 m -59.99 -20.16 56.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.175 -0.466 . . . . 74.02 110.901 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.698 HD23 ' O ' ' A' ' 32' ' ' ALA . 2.1 pp -57.91 -38.79 76.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.114 -0.494 . . . . 72.52 110.964 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.87 -53.13 61.64 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.198 -0.455 . . . . 73.13 110.981 179.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -66.05 -36.89 84.44 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.091 -0.504 . . . . 63.32 111.062 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.721 ' HG2' HD12 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -65.34 -49.34 69.76 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.262 -0.426 . . . . 72.32 110.849 -179.969 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.981 HD11 HD22 ' A' ' 54' ' ' LEU . 4.4 mt -63.64 -35.37 80.31 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.23 -0.441 . . . . 72.11 110.925 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 12.7 tmtt? -59.89 -45.83 91.27 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.19 -0.459 . . . . 62.43 110.877 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 3.2 pt-20 -60.91 -32.77 72.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.191 -0.459 . . . . 75.11 110.913 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 27.0 ttp -68.34 -34.1 75.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 63.43 110.954 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.455 ' CD ' HD11 ' A' ' 48' ' ' LEU . 1.8 mm-40 -59.79 -39.59 85.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 74.45 110.878 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.6 mmpt? -70.56 -30.61 67.38 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.242 -0.436 . . . . 71.43 110.815 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 14.5 t80 -70.4 -42.22 71.95 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.255 -0.43 . . . . 73.32 110.893 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.823 ' CZ ' HD13 ' A' ' 61' ' ' ILE . 7.9 m-85 -82.19 -35.19 28.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.137 -0.483 . . . . 70.43 110.881 -179.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.431 ' HA3' ' HB3' ' A' ' 206' ' ' SER . . . 102.45 -7.81 54.32 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.777 -0.725 . . . . 64.34 112.479 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.529 HD23 ' CB ' ' A' ' 46' ' ' PHE . 0.7 OUTLIER -60.07 138.34 91.13 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-O 121.649 0.737 . . . . 64.11 110.869 -179.941 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.82 -52.12 0.34 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.677 2.252 . . . . 74.5 112.329 179.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.507 HD12 HG23 ' A' ' 58' ' ' VAL . 0.8 OUTLIER -52.08 108.26 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.202 -0.454 . . . . 71.22 111.161 179.914 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.409 ' HA ' ' HG3' ' A' ' 43' ' ' GLN . 6.8 p -101.86 159.09 15.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.135 -0.484 . . . . 73.25 111.166 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 58.44 18.63 37.54 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.734 -0.746 . . . . 64.24 112.484 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 27.8 mmt -103.98 160.98 14.37 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.803 0.335 . . . . 75.23 110.899 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.981 HD22 HD11 ' A' ' 39' ' ' LEU . 25.8 tp -173.69 86.17 0.05 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.271 -0.422 . . . . 73.4 110.952 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.0 p30 174.72 -28.3 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.141 -0.481 . . . . 44.35 110.862 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 25.5 m -94.44 -100.19 0.15 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.244 -0.435 . . . . 75.25 110.844 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.573 ' O ' HG23 ' A' ' 61' ' ' ILE . 3.3 tpp85 -84.79 -29.06 25.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.122 -0.49 . . . . 61.22 110.887 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.507 HG23 HD12 ' A' ' 50' ' ' ILE . 61.5 t -65.72 -41.03 89.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.153 -0.476 . . . . 70.12 111.092 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.415 HD13 ' HA ' ' A' ' 59' ' ' ILE . 1.0 OUTLIER -75.16 -31.61 24.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.244 -0.435 . . . . 74.43 111.195 179.899 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -59.52 -44.23 93.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 73.45 110.86 179.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.823 HD13 ' CZ ' ' A' ' 46' ' ' PHE . 1.3 pp -62.92 -29.03 46.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.149 -0.478 . . . . 74.52 111.12 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.44 ' N ' HG13 ' A' ' 61' ' ' ILE . 3.6 mmt -69.01 -35.03 76.2 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.215 -0.448 . . . . 74.01 110.852 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -88.56 -26.31 22.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.207 -0.452 . . . . 42.22 110.874 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.3 136.27 38.0 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.556 0.693 . . . . 65.34 110.891 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . 0.474 ' HB2' HD22 ' A' ' 156' ' ' LEU . 53.9 Cg_endo -69.74 127.62 14.88 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.621 2.214 . . . . 72.11 112.401 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 5.5 ttm180 -115.02 -88.05 0.58 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.271 -0.422 . . . . 71.51 110.864 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -146.02 156.39 43.45 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.17 -0.468 . . . . 55.3 110.935 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.508 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -98.22 21.05 48.02 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.796 -0.716 . . . . 64.23 112.462 -179.822 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.568 HG21 ' CD2' ' A' ' 198' ' ' HIS . 0.2 OUTLIER -109.79 135.32 20.44 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.627 0.727 . . . . 74.23 111.193 -179.994 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.524 ' HD2' HG12 ' A' ' 69' ' ' VAL . 54.7 Cg_endo -69.78 156.24 63.8 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.715 2.277 . . . . 63.44 112.381 179.964 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -105.84 6.28 31.46 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.26 -0.427 . . . . 74.45 110.867 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.706 HG23 ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -129.22 129.72 67.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.197 -0.456 . . . . 53.43 111.053 -179.924 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -130.78 170.3 14.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.208 -0.451 . . . . 73.13 111.129 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -177.18 173.02 1.84 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.223 -0.444 . . . . 73.31 110.883 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 65.23 152.38 0.06 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.13 -0.486 . . . . 70.41 110.933 -179.792 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 66.82 134.77 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.154 -0.476 . . . . 74.2 110.862 -179.84 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -74.95 -6.47 49.43 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.199 -0.455 . . . . 70.34 110.939 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER 63.69 160.0 0.12 Allowed Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.699 0.761 . . . . 71.24 110.901 180.0 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.431 ' HG3' ' HA2' ' A' ' 163' ' ' GLY . 54.1 Cg_endo -69.69 179.43 3.66 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.681 2.254 . . . . 73.34 112.35 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.822 ' HB2' HG21 ' A' ' 85' ' ' THR . 1.2 m120 -52.02 105.97 0.13 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.21 -0.45 . . . . 74.43 110.899 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 63.73 158.25 0.12 Allowed Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.64 0.733 . . . . 70.4 110.888 -179.807 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.69 -35.06 13.57 Favored 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.627 2.218 . . . . 71.11 112.351 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.647 ' HD2' HD22 ' A' ' 237' ' ' LEU . 26.2 mttp -92.68 165.47 12.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.229 -0.442 . . . . 64.45 110.891 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . 0.431 ' CD1' ' HA ' ' A' ' 200' ' ' LEU . 54.5 m95 -48.66 127.7 14.0 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.191 -0.459 . . . . 73.31 110.981 179.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.822 HG21 ' HB2' ' A' ' 80' ' ' ASN . 15.1 t -115.23 -1.37 12.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.301 -0.409 . . . . 65.3 111.218 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 3.6 m -68.15 -175.94 0.66 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.18 -0.464 . . . . 70.34 110.829 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 2.8 mttt -92.8 -25.03 18.33 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.099 -0.501 . . . . 71.12 110.904 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.43 HG23 ' CD2' ' A' ' 123' ' ' HIS . 0.3 OUTLIER -153.83 142.13 13.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.206 -0.452 . . . . 74.14 111.138 179.91 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 58.8 t -116.6 130.22 71.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 72.25 111.167 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.671 HG22 ' HB3' ' A' ' 125' ' ' ARG . 11.7 p -120.01 168.07 11.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.207 -0.452 . . . . 71.01 111.109 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 2.9 p90 -145.38 146.93 31.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.217 -0.447 . . . . 70.51 110.933 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.431 ' CB ' ' HB3' ' A' ' 132' ' ' ALA . 0.5 OUTLIER -146.21 131.67 18.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.104 -0.498 . . . . 71.25 110.914 179.962 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.452 HD13 ' HB ' ' A' ' 136' ' ' ILE . 18.6 mm -74.99 127.2 36.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.138 -0.483 . . . . 72.4 111.096 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.565 HG22 ' SD ' ' A' ' 135' ' ' MET . 6.5 t -86.38 -40.8 14.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.184 -0.462 . . . . 60.2 111.1 179.826 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 32.9 t -157.16 169.52 24.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.449 . . . . 64.24 110.852 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 11.9 p90 -127.45 155.09 44.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.143 -0.481 . . . . 72.25 110.973 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 3.9 t -95.03 141.26 28.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.116 -0.493 . . . . 64.11 111.16 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 3.6 ptm180 -52.62 -18.96 2.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.287 -0.415 . . . . 72.14 110.836 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.31 -37.75 88.07 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.252 -0.431 . . . . 74.13 110.778 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.757 HD22 HG21 ' A' ' 104' ' ' THR . 1.3 mt -138.65 152.94 71.84 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.613 0.72 . . . . 72.52 110.925 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . 0.579 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.6 Cg_endo -69.69 151.12 69.41 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.788 2.325 . . . . 73.11 112.354 179.817 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 13.1 t-160 -51.27 -26.28 7.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.253 -0.43 . . . . 74.11 110.875 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.579 HG22 ' HB2' ' A' ' 101' ' ' PRO . 12.2 tt -77.53 -38.06 25.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.175 -0.466 . . . . 74.02 111.084 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . 0.757 HG21 HD22 ' A' ' 100' ' ' LEU . 3.0 m -69.01 -40.33 78.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.202 -0.454 . . . . 52.11 111.131 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.76 ' O ' HG13 ' A' ' 109' ' ' VAL . 93.5 t -72.16 -46.19 59.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.266 -0.424 . . . . 71.51 111.097 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.662 ' O ' HG22 ' A' ' 109' ' ' VAL . 45.6 t0 -59.35 -45.69 90.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.202 -0.453 . . . . 63.44 110.842 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -70.36 -33.53 71.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.186 -0.461 . . . . 75.02 110.815 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.622 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -60.3 -49.09 78.99 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.246 -0.434 . . . . 71.04 110.888 -179.958 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.76 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.5 m -55.62 -41.49 64.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.153 -0.476 . . . . 72.31 111.045 179.892 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.465 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 37.5 t -70.0 -33.76 72.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.183 -0.462 . . . . 72.14 110.819 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.429 ' CG ' HD21 ' A' ' 189' ' ' LEU . 0.3 OUTLIER -61.92 -33.3 73.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.152 -0.476 . . . . 74.35 110.864 179.954 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -95.87 -40.28 9.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.225 -0.443 . . . . 74.32 111.092 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.696 ' CD1' HD12 ' A' ' 196' ' ' LEU . 0.4 OUTLIER -65.24 -32.9 74.81 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.205 -0.452 . . . . 72.0 110.92 -179.954 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 38.9 t30 -64.66 -35.51 81.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 72.34 110.846 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . 0.542 ' O ' HD11 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -67.49 -33.79 75.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.174 -0.466 . . . . 54.12 110.862 179.932 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 9.4 m95 -70.58 -52.47 21.36 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.186 -0.461 . . . . 75.23 110.904 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -60.24 -43.61 98.31 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.724 -0.751 . . . . 73.32 112.494 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.97 -19.06 60.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.714 0.292 . . . . 72.42 110.85 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.73 ' HG2' HD13 ' A' ' 226' ' ' LEU . 0.2 OUTLIER -96.29 13.4 27.72 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.235 -0.438 . . . . 75.24 110.886 179.952 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 1.043 HD12 HD12 ' A' ' 122' ' ' LEU . 8.6 pt -146.89 147.04 28.32 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.55 0.691 . . . . 71.34 111.2 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 5.72 1.59 Allowed 'Trans proline' 0 C--O 1.233 0.245 0 C-N-CA 122.655 2.236 . . . . 72.21 112.32 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 1.043 HD12 HD12 ' A' ' 120' ' ' ILE . 10.9 mt -61.12 -160.96 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.2 -0.454 . . . . 73.22 110.894 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.43 ' CD2' HG23 ' A' ' 88' ' ' VAL . 3.5 t-160 -150.67 123.18 8.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.228 -0.442 . . . . 74.12 110.803 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 11.1 m-30 -107.54 148.76 28.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.253 -0.43 . . . . 75.54 110.934 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.671 ' HB3' HG22 ' A' ' 90' ' ' THR . 0.0 OUTLIER -133.03 141.24 48.14 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.153 -0.476 . . . . 75.14 110.843 -179.884 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.8 139.71 35.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 72.22 110.841 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . 0.92 HG11 ' HB2' ' A' ' 132' ' ' ALA . 19.1 m -102.91 133.43 46.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.228 -0.442 . . . . 50.13 111.046 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.446 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -146.68 -23.59 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.157 -0.474 . . . . 74.43 111.064 179.936 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' TRP . . . . . 0.446 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -138.59 109.3 6.64 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.195 -0.457 . . . . 71.25 110.961 179.924 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 108.48 -159.37 14.27 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.727 -0.749 . . . . 62.11 112.496 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.75 155.4 18.15 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.734 0.302 . . . . 63.25 111.158 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . 0.92 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -112.87 165.33 12.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.225 -0.443 . . . . 51.34 111.104 179.851 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -65.37 -60.31 3.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.25 -0.432 . . . . 75.41 110.85 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 19.3 mt -90.7 129.42 41.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.161 -0.472 . . . . 70.51 111.124 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . 0.565 ' SD ' HG22 ' A' ' 94' ' ' VAL . 0.0 OUTLIER -107.85 122.97 47.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.136 -0.483 . . . . 72.43 110.869 179.882 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.452 ' HB ' HD13 ' A' ' 93' ' ' ILE . 0.8 OUTLIER -105.64 95.73 4.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.239 -0.437 . . . . 70.04 111.132 179.944 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . 0.4 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -130.96 166.62 22.6 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.73 -0.747 . . . . 63.34 112.542 179.851 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' PHE . . . . . 0.499 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 60.3 m-85 -105.28 149.14 26.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.912 0.387 . . . . 74.01 110.848 -179.859 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.617 ' HB1' ' CB ' ' A' ' 143' ' ' HIS . . . 173.89 167.23 0.2 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.116 -0.493 . . . . 71.21 111.105 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 33.3 mtt180 -104.19 173.39 6.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.217 -0.447 . . . . 62.21 110.871 -179.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -57.46 -15.3 16.41 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.681 -0.771 . . . . 74.24 112.475 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -100.91 14.17 32.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.85 0.357 . . . . 75.03 111.09 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . 0.617 ' CB ' ' HB1' ' A' ' 139' ' ' ALA . 8.9 p80 -68.19 -33.35 74.28 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.249 -0.432 . . . . 71.11 110.881 179.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 147.28 47.13 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.765 -0.731 . . . . 45.51 112.491 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -158.82 149.57 20.04 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.763 0.316 . . . . 72.14 110.857 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . 0.475 ' O ' ' CB ' ' A' ' 147' ' ' TYR . 49.0 p -63.73 99.12 0.21 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.224 -0.444 . . . . 51.25 110.888 -179.777 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' TYR . . . . . 0.475 ' CB ' ' O ' ' A' ' 146' ' ' SER . 0.2 OUTLIER 163.04 121.21 0.0 OUTLIER Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.704 0.764 . . . . 73.4 110.848 -179.874 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.74 138.47 37.95 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.705 2.27 . . . . 74.53 112.372 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 149' ' ' PHE . . . . . 0.44 ' C ' ' H ' ' A' ' 151' ' ' GLY . 7.6 p90 -53.84 -42.38 68.44 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.209 -0.451 . . . . 63.52 110.841 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 75.61 -21.93 0.29 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.184 -0.462 . . . . 63.11 110.927 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . 0.44 ' H ' ' C ' ' A' ' 149' ' ' PHE . . . 78.83 -159.49 45.89 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.678 -0.773 . . . . 71.41 112.515 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.67 142.41 48.26 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.711 2.274 . . . . 75.11 112.363 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . 0.437 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 104.34 -137.52 13.62 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.752 -0.737 . . . . 70.32 112.522 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 154' ' ' ASN . . . . . 0.437 ' C ' ' O ' ' A' ' 153' ' ' GLY . 3.4 p30 -34.86 141.32 0.06 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.944 0.402 . . . . 73.25 110.826 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 155' ' ' THR . . . . . 0.5 HG23 ' HA2' ' A' ' 68' ' ' GLY . 0.2 OUTLIER 75.22 90.07 0.08 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.15 -0.477 . . . . 44.41 111.16 -179.964 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . 0.737 HD21 ' CG2' ' A' ' 186' ' ' ILE . 0.0 OUTLIER -71.9 -59.35 2.79 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.162 -0.472 . . . . 75.02 110.914 179.953 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . 0.508 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -161.59 148.82 14.57 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.198 -0.455 . . . . 71.42 111.088 179.779 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 158' ' ' HIS . . . . . 0.403 ' O ' ' HB2' ' A' ' 171' ' ' HIS . 15.4 p-80 -103.47 124.38 48.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.194 -0.457 . . . . 72.02 110.862 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.466 ' H ' HG22 ' A' ' 69' ' ' VAL . . . -110.58 159.41 17.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.225 -0.443 . . . . 74.42 111.083 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 14.2 m-85 -112.58 152.24 29.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.217 -0.447 . . . . 75.31 110.88 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . 0.68 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -81.67 163.64 53.01 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.591 0.71 . . . . 61.04 111.113 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 162' ' ' PRO . . . . . 0.68 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.6 Cg_endo -69.81 79.28 0.97 Allowed 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.667 2.245 . . . . 74.44 112.354 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 163' ' ' GLY . . . . . 0.431 ' HA2' ' HG3' ' A' ' 79' ' ' PRO . . . -148.87 122.8 1.53 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.752 -0.737 . . . . 61.41 112.504 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 1.1 m 66.43 149.75 0.05 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.803 0.335 . . . . 73.1 111.138 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -52.76 -45.45 60.65 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.687 -0.768 . . . . 74.03 112.474 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 166' ' ' LEU . . . . . 0.457 ' C ' HD23 ' A' ' 166' ' ' LEU . 10.1 tt -64.25 -39.9 94.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.891 0.377 . . . . 65.12 110.993 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -78.79 170.49 54.77 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.788 -0.72 . . . . 43.43 112.439 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 80.46 22.86 61.62 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.765 -0.731 . . . . 74.31 112.457 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 85.5 m-20 -96.32 165.13 12.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.853 0.359 . . . . 63.41 110.886 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.44 130.9 55.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.196 -0.456 . . . . 74.21 111.08 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 171' ' ' HIS . . . . . 0.403 ' HB2' ' O ' ' A' ' 158' ' ' HIS . 25.0 m170 -125.05 158.74 33.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.224 -0.444 . . . . 72.53 110.861 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -140.87 137.73 33.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.252 -0.431 . . . . 71.44 110.884 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 173' ' ' ASP . . . . . 0.421 ' HB3' ' OE1' ' A' ' 176' ' ' GLU . 13.6 t0 -70.85 100.92 2.02 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.133 -0.485 . . . . 74.11 110.861 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.05 -11.45 39.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.173 -0.467 . . . . 72.25 110.903 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -78.79 -16.53 57.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.143 -0.48 . . . . 73.32 110.85 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 176' ' ' GLU . . . . . 0.437 ' CD ' HD13 ' A' ' 156' ' ' LEU . 1.4 mt-10 -90.53 -168.83 2.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.253 -0.431 . . . . 63.2 110.893 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 54.1 mtt85 -115.64 121.49 42.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.162 -0.472 . . . . 63.14 110.869 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 60.4 m95 -116.92 144.42 44.56 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.213 -0.449 . . . . 72.31 110.916 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 179' ' ' THR . . . . . 0.609 ' HA ' HD21 ' A' ' 100' ' ' LEU . 2.5 t -177.0 163.81 2.21 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.224 -0.444 . . . . 74.13 111.139 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -125.07 -70.0 0.77 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.194 -0.457 . . . . 45.33 110.845 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -67.74 -10.8 59.09 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.68 -0.772 . . . . 62.41 112.529 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 182' ' ' SER . . . . . 0.518 ' HB3' HG21 ' A' ' 179' ' ' THR . 0.3 OUTLIER -95.07 -24.54 16.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.914 0.388 . . . . 64.5 110.881 -179.723 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 183' ' ' SER . . . . . 0.464 ' C ' ' O ' ' A' ' 182' ' ' SER . 56.8 m 32.94 66.17 0.21 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.076 -0.511 . . . . 64.12 110.898 -179.79 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 6.4 tp -116.9 -33.61 4.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.162 -0.472 . . . . 74.2 110.885 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -128.91 -128.26 3.04 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.756 -0.735 . . . . 73.01 112.506 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 186' ' ' ILE . . . . . 0.737 ' CG2' HD21 ' A' ' 156' ' ' LEU . 4.6 mm -79.33 97.56 2.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.856 0.36 . . . . 73.22 111.178 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -54.75 121.17 7.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.177 -0.465 . . . . 71.31 110.91 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 188' ' ' PHE . . . . . 0.639 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.3 t80 -54.43 -33.16 58.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.145 -0.479 . . . . 75.45 110.867 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . 0.644 HD12 ' CD2' ' A' ' 224' ' ' PHE . 0.1 OUTLIER -67.15 -47.93 69.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.134 -0.484 . . . . 52.02 110.965 -179.986 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 85.7 t80 -70.14 -38.09 75.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.142 -0.481 . . . . 74.22 110.962 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 191' ' ' ALA . . . . . 0.439 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -72.68 -35.4 67.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.098 -0.501 . . . . 50.03 111.027 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 192' ' ' ALA . . . . . 0.672 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -56.8 -44.88 82.38 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.277 -0.42 . . . . 52.11 111.143 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 193' ' ' THR . . . . . 0.587 HG21 ' HE1' ' A' ' 224' ' ' PHE . 0.6 OUTLIER -58.87 -43.04 90.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 72.43 111.177 -179.917 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 11.7 t-160 -72.88 -38.02 67.13 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.166 -0.47 . . . . 71.44 110.861 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -75.5 -47.44 27.02 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.15 -0.477 . . . . 71.01 111.104 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 196' ' ' LEU . . . . . 0.696 HD12 ' CD1' ' A' ' 113' ' ' LEU . 4.6 mm? -63.19 -43.98 96.67 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.234 -0.439 . . . . 74.51 110.864 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -59.14 -28.7 64.43 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.714 -0.755 . . . . 52.23 112.425 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 198' ' ' HIS . . . . . 0.568 ' CD2' HG21 ' A' ' 69' ' ' VAL . 5.1 m-70 -65.69 -32.88 74.68 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.789 0.328 . . . . 75.21 110.817 -179.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.57 -21.17 60.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.24 -0.436 . . . . 71.13 110.849 -179.768 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 200' ' ' LEU . . . . . 0.431 ' HA ' ' CD1' ' A' ' 84' ' ' TRP . 0.6 OUTLIER -88.72 2.3 53.61 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.131 -0.486 . . . . 64.13 110.916 179.946 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 84.12 -9.02 64.78 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.718 -0.753 . . . . 50.41 112.446 179.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 202' ' ' MET . . . . . . . . . . . . . 37.6 tpp -51.51 138.94 21.2 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.806 0.336 . . . . 63.21 110.855 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -105.12 159.06 15.8 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.744 -0.741 . . . . 64.44 112.53 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 16.0 m-70 -55.52 163.38 1.29 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.813 0.34 . . . . 74.32 110.838 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -123.61 147.81 47.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.184 -0.462 . . . . 53.34 110.834 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 206' ' ' SER . . . . . 0.431 ' HB3' ' HA3' ' A' ' 47' ' ' GLY . 0.7 OUTLIER -88.14 -4.03 58.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.128 -0.487 . . . . 72.22 110.854 -179.81 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -70.99 138.58 85.06 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.626 0.727 . . . . 65.11 110.836 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 -8.96 24.91 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.626 2.217 . . . . 74.53 112.37 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -127.98 29.71 5.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.237 -0.438 . . . . 63.52 110.934 179.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 210' ' ' ALA . . . . . 0.457 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.37 145.86 26.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.201 -0.454 . . . . 62.23 111.059 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -67.73 -28.77 42.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.246 -0.434 . . . . 62.04 111.115 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.75 8.84 42.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.149 -0.478 . . . . 75.22 110.908 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 213' ' ' TYR . . . . . 0.411 ' HA ' ' HD2' ' A' ' 214' ' ' PRO . 1.8 t80 -55.73 115.02 8.42 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.703 0.763 . . . . 73.43 110.925 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 214' ' ' PRO . . . . . 0.411 ' HD2' ' HA ' ' A' ' 213' ' ' TYR . 54.3 Cg_endo -69.67 -17.79 37.78 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.711 2.274 . . . . 63.01 112.389 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 215' ' ' THR . . . . . 0.402 ' HB ' ' CE2' ' A' ' 213' ' ' TYR . 0.2 OUTLIER -83.77 55.6 3.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.215 -0.448 . . . . 74.24 111.139 -179.946 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -85.11 122.78 29.81 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.206 -0.452 . . . . 74.14 110.942 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -147.87 -59.31 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.703 -0.761 . . . . 74.22 112.47 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 24.7 p-10 -51.7 170.38 0.05 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.924 0.392 . . . . 64.22 110.871 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . -50.89 157.24 2.45 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.732 -0.747 . . . . 72.24 112.531 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 220' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -75.19 153.67 86.31 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.604 0.716 . . . . 41.43 110.88 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -69.83 135.78 31.17 Favored 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.661 2.241 . . . . 73.42 112.355 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 11.3 mp0 -62.57 -38.87 91.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.259 -0.428 . . . . 74.21 110.868 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 87.1 m-20 -121.74 -34.93 3.3 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.237 -0.438 . . . . 60.33 110.937 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 224' ' ' PHE . . . . . 0.644 ' CD2' HD12 ' A' ' 189' ' ' LEU . 0.0 OUTLIER 66.75 135.84 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.113 -0.494 . . . . 65.01 110.882 -179.988 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.75 154.67 43.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 64.24 110.91 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . 0.73 HD13 ' HG2' ' A' ' 119' ' ' GLU . 12.0 mt -69.98 148.66 48.62 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.268 -0.424 . . . . 53.44 110.931 179.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 227' ' ' SER . . . . . 0.457 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 0.0 OUTLIER -86.65 155.43 20.41 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.154 -0.476 . . . . 74.21 110.861 -179.886 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 42.6 mt-30 -67.45 -66.09 0.6 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.109 -0.496 . . . . 74.54 110.98 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 229' ' ' ASP . . . . . 0.41 ' O ' ' HG2' ' A' ' 232' ' ' LYS . 1.0 OUTLIER -55.74 -26.63 46.48 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.156 -0.474 . . . . 72.22 110.864 179.959 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -69.1 -50.66 46.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.141 -0.481 . . . . 74.23 110.881 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 231' ' ' ILE . . . . . 0.694 HD11 HD22 ' A' ' 226' ' ' LEU . 2.8 mm -70.43 -42.18 78.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.222 -0.445 . . . . 73.41 111.118 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 232' ' ' LYS . . . . . 0.41 ' HG2' ' O ' ' A' ' 229' ' ' ASP . 0.0 OUTLIER -56.47 -32.34 64.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.22 -0.445 . . . . 65.42 110.904 179.84 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -64.55 -50.01 61.53 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.753 -0.737 . . . . 63.43 112.437 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 5.5 tt -73.19 -30.81 32.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.731 0.301 . . . . 71.54 111.089 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -66.38 -24.16 66.45 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.256 -0.429 . . . . 70.33 110.923 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 236' ' ' LYS . . . . . 0.463 ' HE2' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.1 -20.61 60.21 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.239 -0.437 . . . . 51.21 110.904 179.918 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 237' ' ' LEU . . . . . 0.647 HD22 ' HD2' ' A' ' 83' ' ' LYS . 9.8 tt -97.21 -31.38 12.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.217 -0.447 . . . . 75.41 110.935 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 238' ' ' TYR . . . . . 0.456 ' CZ ' HD11 ' A' ' 122' ' ' LEU . 26.4 m-85 -92.16 -35.02 14.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 51.24 110.901 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -136.94 -119.64 1.86 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.69 -0.767 . . . . 32.22 112.47 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 3.5 tttm -96.8 156.78 16.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.722 0.296 . . . . 75.42 110.916 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 11.1 ptt180 -92.08 -172.58 3.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.245 -0.434 . . . . 73.34 110.838 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -139.2 -179.75 6.05 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.196 -0.456 . . . . 62.42 110.864 -179.852 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 16.4 m120 -122.85 99.88 6.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.136 -0.484 . . . . 72.13 110.874 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -179.78 162.72 1.08 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.189 -0.459 . . . . 62.23 110.807 -179.852 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -160.32 174.6 13.93 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.114 -0.494 . . . . 70.43 110.899 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -130.75 -55.24 1.07 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.156 -0.474 . . . . 72.11 110.905 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.24 -0.436 . . . . 74.13 110.872 179.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 302' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' -2' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.095 0 CA-C-O 121.599 0.714 . . . . 73.02 110.933 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' -1' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.74 178.43 4.56 Favored 'Trans proline' 0 C--O 1.232 0.211 0 C-N-CA 122.694 2.263 . . . . 71.15 112.336 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -91.89 159.17 38.6 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-O 121.637 0.732 . . . . 62.13 110.953 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.77 -48.37 0.73 Allowed 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.729 2.286 . . . . 64.14 112.367 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -179.1 38.8 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.229 -0.441 . . . . 60.51 110.933 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -58.75 -26.32 63.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 74.01 110.922 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -59.74 -33.96 72.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.123 -0.49 . . . . 71.4 111.151 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -58.24 -38.4 89.95 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.76 -0.733 . . . . 60.51 112.465 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -109.03 21.58 26.93 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.75 -0.738 . . . . 54.22 112.494 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 5.7 mtt -61.31 161.03 9.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.823 0.344 . . . . 72.23 110.894 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 53.3 m -101.43 168.69 9.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.259 -0.428 . . . . 73.24 110.883 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -54.39 -33.23 58.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.136 -0.484 . . . . 50.12 110.852 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -68.36 -42.88 78.55 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.185 -0.461 . . . . 72.33 110.927 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.8 tp-100 -69.69 -39.63 76.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.189 -0.459 . . . . 72.14 110.893 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.582 ' CH2' HD23 ' A' ' 54' ' ' LEU . 70.0 t-105 -70.55 -41.49 72.41 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.202 -0.454 . . . . 71.22 110.872 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -72.2 -35.16 68.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.314 -0.403 . . . . 72.51 110.886 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -71.34 -36.51 71.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.113 -0.494 . . . . 61.24 110.946 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.587 ' HB1' ' SD ' ' A' ' 62' ' ' MET . . . -65.82 -44.1 86.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.254 -0.43 . . . . 54.34 111.076 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.571 ' OE1' HD21 ' A' ' 35' ' ' LEU . 0.0 OUTLIER -73.79 -31.92 63.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.264 -0.425 . . . . 73.12 110.865 -179.92 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.506 ' N ' ' HG3' ' A' ' 16' ' ' GLN . 74.5 m-20 -77.72 -31.09 52.05 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.259 -0.428 . . . . 72.4 110.898 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -59.75 -36.32 76.4 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.175 -0.466 . . . . 75.11 110.902 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.449 HD22 ' HA ' ' A' ' 19' ' ' LEU . 0.2 OUTLIER -72.24 -20.99 61.45 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.19 -0.459 . . . . 72.51 110.911 179.998 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 4.2 ptmt -74.0 -27.86 61.17 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.177 -0.465 . . . . 74.41 110.877 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.0 ptp180 -86.34 -27.73 24.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.23 -0.441 . . . . 74.05 110.804 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -60.16 -21.18 61.34 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.219 -0.446 . . . . 74.31 110.859 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.512 ' HB3' HG21 ' A' ' 72' ' ' VAL . 12.5 m-85 -120.38 50.41 1.32 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.134 -0.484 . . . . 72.55 110.952 -179.83 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.532 ' HG ' HG23 ' A' ' 72' ' ' VAL . 3.8 mt 68.64 -168.03 0.18 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.11 -0.496 . . . . 75.43 110.916 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -92.49 89.9 6.95 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.15 -0.477 . . . . 71.41 110.926 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -113.94 116.28 29.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.167 -0.47 . . . . 74.25 110.822 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 99.9 p -85.19 -6.39 59.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.235 -0.438 . . . . 62.15 110.885 -179.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.9 -15.36 58.85 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.125 -0.489 . . . . 74.51 110.895 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -80.87 0.86 33.29 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.133 -0.485 . . . . 70.44 111.098 -179.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.7 mptt -58.51 170.12 0.8 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.235 -0.439 . . . . 73.33 110.922 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 25.6 t30 65.55 156.78 0.09 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.285 -0.416 . . . . 64.43 110.861 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.588 ' HA ' HD13 ' A' ' 35' ' ' LEU . . . -74.69 -23.95 58.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.172 -0.467 . . . . 70.21 111.057 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -65.56 -18.8 65.59 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.226 -0.443 . . . . 35.31 110.888 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 52.8 m -85.58 -33.6 21.66 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.209 -0.451 . . . . 74.02 110.81 -179.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.588 HD13 ' HA ' ' A' ' 32' ' ' ALA . 10.8 mp -57.56 -44.89 85.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.163 -0.471 . . . . 72.52 110.952 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -61.8 -51.47 68.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.166 -0.47 . . . . 73.13 110.913 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -61.48 -50.51 72.47 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.116 -0.493 . . . . 63.32 111.138 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.83 -38.28 81.57 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.152 -0.476 . . . . 72.32 110.92 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.654 HD21 HD22 ' A' ' 54' ' ' LEU . 1.6 mp -61.63 -39.45 91.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.161 -0.472 . . . . 72.11 110.852 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 37.9 mttp -66.22 -46.71 76.25 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.205 -0.452 . . . . 62.43 110.935 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -70.57 -33.04 70.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.188 -0.46 . . . . 75.11 110.903 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.725 ' CE ' HD11 ' A' ' 61' ' ' ILE . 0.0 OUTLIER -67.31 -47.5 70.38 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.164 -0.471 . . . . 63.43 110.884 179.951 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.947 ' HA ' HD12 ' A' ' 48' ' ' LEU . 31.4 mt-30 -59.0 -42.8 90.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.225 -0.443 . . . . 74.45 110.96 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.3 mmpt? -59.6 -27.76 66.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.223 -0.444 . . . . 71.43 110.874 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -70.56 -37.67 74.04 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.24 -0.436 . . . . 73.32 110.834 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.728 ' CD2' HD12 ' A' ' 61' ' ' ILE . 31.3 m-85 -83.94 9.52 12.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.171 -0.468 . . . . 70.43 110.879 -179.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.457 ' HA2' ' HB3' ' A' ' 206' ' ' SER . . . 76.55 11.81 84.89 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.782 -0.723 . . . . 64.34 112.474 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.947 HD12 ' HA ' ' A' ' 43' ' ' GLN . 6.1 mt -76.4 121.73 85.44 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.56 0.695 . . . . 64.11 110.952 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.83 -44.77 1.84 Allowed 'Trans proline' 0 C--O 1.231 0.16 0 C-N-CA 122.643 2.229 . . . . 74.5 112.35 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 13.1 pt -58.87 129.67 21.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.193 -0.458 . . . . 71.22 111.144 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 76.5 p -115.2 128.88 56.45 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.127 -0.488 . . . . 73.25 111.179 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 90.95 30.03 11.93 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.746 -0.74 . . . . 64.24 112.45 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.749 ' O ' HG21 ' A' ' 58' ' ' VAL . 2.6 mmt -130.98 133.91 46.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.873 0.368 . . . . 75.23 110.845 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.654 HD22 HD21 ' A' ' 39' ' ' LEU . 17.3 tp -154.13 95.94 1.89 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.114 -0.493 . . . . 73.4 110.946 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.402 ' HA ' HG13 ' A' ' 59' ' ' ILE . 1.8 t-20 171.01 -26.48 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.198 -0.455 . . . . 44.35 110.93 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 18.6 m -89.38 -99.62 0.09 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.118 -0.492 . . . . 75.25 110.855 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.638 ' O ' HG23 ' A' ' 61' ' ' ILE . 12.2 tpt85 -84.53 -27.42 27.37 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.199 -0.455 . . . . 61.22 110.905 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.749 HG21 ' O ' ' A' ' 53' ' ' MET . 24.8 t -58.06 -44.31 86.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.143 -0.48 . . . . 70.12 111.119 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.402 HG13 ' HA ' ' A' ' 55' ' ' ASN . 9.9 mm -74.55 -30.89 26.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.147 -0.479 . . . . 74.43 111.219 179.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -59.2 -35.04 72.89 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.119 -0.491 . . . . 73.45 110.892 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.728 HD12 ' CD2' ' A' ' 46' ' ' PHE . 0.4 OUTLIER -76.12 -29.18 19.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.194 -0.457 . . . . 74.52 111.13 179.951 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.587 ' SD ' ' HB1' ' A' ' 15' ' ' ALA . 7.0 mtt -61.76 -39.48 91.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.192 -0.458 . . . . 74.01 110.872 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -81.51 -22.73 37.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.22 -0.445 . . . . 42.22 110.873 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.1 mtmt -85.22 126.45 67.31 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.565 0.698 . . . . 65.34 110.95 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.66 140.1 42.22 Favored 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.72 2.28 . . . . 72.11 112.368 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.521 ' O ' HD23 ' A' ' 156' ' ' LEU . 0.2 OUTLIER -134.87 -77.72 0.45 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.254 -0.43 . . . . 71.51 110.901 -179.983 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -145.26 148.81 33.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.469 . . . . 55.3 110.926 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.594 ' HA3' HG22 ' A' ' 155' ' ' THR . . . -106.46 28.31 13.94 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.678 -0.773 . . . . 64.23 112.52 -179.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.694 HG21 ' CD2' ' A' ' 198' ' ' HIS . 0.2 OUTLIER -106.12 134.26 19.84 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 121.622 0.725 . . . . 74.23 111.135 -179.97 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.467 ' HD2' HG12 ' A' ' 69' ' ' VAL . 54.2 Cg_endo -69.7 132.69 23.96 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.706 2.27 . . . . 63.44 112.326 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -93.29 22.16 5.42 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.245 -0.434 . . . . 74.45 110.887 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.532 HG23 ' HG ' ' A' ' 24' ' ' LEU . 3.1 m -136.85 129.9 45.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.154 -0.475 . . . . 53.43 111.124 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -130.87 170.29 14.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.168 -0.469 . . . . 73.13 111.064 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 178.48 94.3 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.184 -0.462 . . . . 73.31 110.881 -179.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -160.62 163.85 32.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.184 -0.462 . . . . 70.41 110.908 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -111.65 175.31 5.48 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.058 -0.519 . . . . 74.2 110.871 -179.872 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 9.7 mt 62.55 16.94 9.19 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.167 -0.47 . . . . 70.34 110.923 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 15.7 p90 -57.17 156.71 13.62 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.599 0.714 . . . . 71.24 110.884 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.7 171.85 13.64 Favored 'Trans proline' 0 C--N 1.341 0.145 0 C-N-CA 122.716 2.277 . . . . 73.34 112.32 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.69 ' HB2' HG21 ' A' ' 85' ' ' THR . 0.4 OUTLIER -54.44 100.73 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.205 -0.452 . . . . 74.43 110.851 179.925 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 63.05 158.77 0.12 Allowed Pre-proline 0 C--N 1.33 -0.266 0 CA-C-O 121.621 0.724 . . . . 70.4 110.903 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.74 -10.81 29.49 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.696 2.264 . . . . 71.11 112.334 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.844 ' HD2' HD22 ' A' ' 237' ' ' LEU . 9.4 mttt -106.56 171.0 7.59 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.189 -0.46 . . . . 64.45 110.954 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 61.0 m95 -56.53 131.15 47.85 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.239 -0.437 . . . . 73.31 110.933 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.69 HG21 ' HB2' ' A' ' 80' ' ' ASN . 4.8 t -115.19 -16.34 11.56 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.172 -0.467 . . . . 65.3 111.089 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 3.3 m -59.06 172.89 0.51 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.247 -0.433 . . . . 70.34 110.887 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 2.8 mptp? -85.04 -21.17 29.51 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.124 -0.489 . . . . 71.12 110.931 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.458 HG23 ' CD2' ' A' ' 123' ' ' HIS . 0.3 OUTLIER -154.8 143.57 13.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.197 -0.456 . . . . 74.14 111.111 179.836 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 25.7 t -119.64 130.44 74.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.167 -0.47 . . . . 72.25 111.171 179.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.671 HG22 ' HB3' ' A' ' 125' ' ' ARG . 43.5 p -115.77 163.53 15.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.471 . . . . 71.01 111.1 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 4.7 p90 -145.96 146.22 30.95 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.207 -0.451 . . . . 70.51 110.923 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 3.7 ttt-85 -151.69 139.09 19.46 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.131 -0.486 . . . . 71.25 110.849 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.522 HD11 ' HA ' ' A' ' 106' ' ' ASP . 11.1 mm -74.84 131.28 35.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.162 -0.472 . . . . 72.4 111.141 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.677 HG22 ' SD ' ' A' ' 135' ' ' MET . 9.3 t -88.6 -40.74 13.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.461 . . . . 60.2 111.183 179.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -151.52 169.36 22.27 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.128 -0.487 . . . . 64.24 110.792 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 13.8 p90 -129.63 155.08 46.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.11 -0.496 . . . . 72.25 110.98 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 2.1 t -102.79 141.84 34.92 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.183 -0.462 . . . . 64.11 111.194 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.44 -18.72 1.78 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.27 -0.423 . . . . 72.14 110.866 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -65.16 -37.32 87.0 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.158 -0.474 . . . . 74.13 110.847 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.413 HD21 ' HA ' ' A' ' 179' ' ' THR . 1.3 mp -142.37 152.82 61.62 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.681 0.753 . . . . 72.52 110.858 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . 0.59 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.4 Cg_endo -69.76 150.97 68.92 Favored 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 122.689 2.259 . . . . 73.11 112.337 179.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 3.7 t-160 -52.7 -25.62 11.53 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.225 -0.443 . . . . 74.11 110.882 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.59 HG22 ' HB2' ' A' ' 101' ' ' PRO . 13.9 tt -77.36 -39.2 27.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.15 -0.477 . . . . 74.02 111.098 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . 0.78 ' O ' HD22 ' A' ' 108' ' ' LEU . 3.6 m -69.13 -36.21 77.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.18 -0.463 . . . . 52.11 111.181 179.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.772 HG13 ' CZ ' ' A' ' 188' ' ' PHE . 60.2 t -71.93 -42.91 68.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.226 -0.443 . . . . 71.51 111.126 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.654 ' O ' HG22 ' A' ' 109' ' ' VAL . 0.0 OUTLIER -67.02 -37.19 83.69 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.171 -0.468 . . . . 63.44 110.845 179.92 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . 0.49 ' HG3' ' N ' ' A' ' 108' ' ' LEU . 0.0 OUTLIER -70.72 -33.27 70.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.172 -0.467 . . . . 75.02 110.891 -179.876 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.78 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -66.44 -47.77 72.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.21 -0.45 . . . . 71.04 110.916 -179.978 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.767 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.5 m -55.03 -42.99 67.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.146 -0.479 . . . . 72.31 111.091 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.493 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 30.2 t -70.62 -33.8 71.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.256 -0.429 . . . . 72.14 110.858 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.465 ' HB3' HD21 ' A' ' 189' ' ' LEU . 0.3 OUTLIER -62.02 -33.11 73.76 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.17 -0.468 . . . . 74.35 110.913 179.914 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.7 -40.14 9.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.188 -0.46 . . . . 74.32 111.048 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.695 ' CD1' HD12 ' A' ' 196' ' ' LEU . 0.4 OUTLIER -64.73 -33.26 75.55 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.249 -0.432 . . . . 72.0 110.909 -179.997 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -66.38 -34.89 78.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.183 -0.462 . . . . 72.34 110.861 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . 0.883 ' HB3' HD23 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -70.24 -33.33 71.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 54.12 110.843 179.927 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' TRP . . . . . 0.602 ' CZ3' HD11 ' A' ' 226' ' ' LEU . 6.3 m95 -70.16 -42.76 72.05 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.232 -0.44 . . . . 75.23 110.898 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -72.89 -40.81 51.21 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.735 -0.745 . . . . 73.32 112.43 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.3 ptpt -61.34 -14.52 27.75 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.802 0.334 . . . . 72.42 110.897 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.641 ' HB3' HG23 ' A' ' 231' ' ' ILE . 41.9 mm-40 -100.69 13.39 35.0 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.241 -0.436 . . . . 75.24 110.838 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 1.133 HD12 HD12 ' A' ' 122' ' ' LEU . 6.6 pt -147.99 144.55 19.12 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.635 0.731 . . . . 71.34 111.099 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.72 24.57 0.17 Allowed 'Trans proline' 0 C--O 1.232 0.221 0 C-N-CA 122.673 2.249 . . . . 72.21 112.367 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 1.133 HD12 HD12 ' A' ' 120' ' ' ILE . 6.3 mt -77.46 -159.71 0.15 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.167 -0.47 . . . . 73.22 110.902 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.458 ' CD2' HG23 ' A' ' 88' ' ' VAL . 3.4 t-160 -151.19 120.98 7.03 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.184 -0.462 . . . . 74.12 110.934 179.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 11.0 m-30 -110.36 148.44 31.97 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.224 -0.443 . . . . 75.54 110.891 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.671 ' HB3' HG22 ' A' ' 90' ' ' THR . 0.0 OUTLIER -129.91 141.35 50.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.125 -0.489 . . . . 75.14 110.853 -179.872 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.14 145.25 31.13 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.247 -0.433 . . . . 72.22 110.875 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . 1.031 HG11 ' HB2' ' A' ' 132' ' ' ALA . 30.4 m -103.3 126.58 57.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.248 -0.433 . . . . 50.13 111.097 179.861 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.464 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -142.07 -22.62 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.116 -0.493 . . . . 74.43 111.187 179.859 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' TRP . . . . . 0.464 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -140.72 109.15 5.86 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.104 -0.498 . . . . 71.25 110.92 179.92 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.07 -162.24 13.53 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.747 -0.74 . . . . 62.11 112.521 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 3.2 m -101.79 156.61 17.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.79 0.329 . . . . 63.25 111.13 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . 1.031 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -111.22 165.2 12.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.218 -0.446 . . . . 51.34 111.136 179.808 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -69.05 -55.33 11.13 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.188 -0.46 . . . . 75.41 110.883 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . 0.428 HG22 ' CD1' ' A' ' 136' ' ' ILE . 41.1 mt -82.7 131.06 34.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.196 -0.456 . . . . 70.51 111.12 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . 0.677 ' SD ' HG22 ' A' ' 94' ' ' VAL . 27.2 mmt -108.06 118.37 36.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.162 -0.472 . . . . 72.43 110.964 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.428 ' CD1' HG22 ' A' ' 134' ' ' ILE . 0.8 OUTLIER -106.16 89.87 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.316 -0.402 . . . . 70.04 111.166 179.955 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . 0.402 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -129.53 169.45 20.73 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.774 -0.726 . . . . 63.34 112.509 179.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' PHE . . . . . 0.605 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 45.5 m-85 -106.04 147.04 29.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.888 0.375 . . . . 74.01 110.945 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.605 ' HB2' ' O ' ' A' ' 138' ' ' PHE . . . 167.48 166.19 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.142 -0.481 . . . . 71.21 111.105 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.426 ' HB2' ' HB3' ' A' ' 149' ' ' PHE . 1.0 OUTLIER -109.28 174.36 5.9 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.216 -0.447 . . . . 62.21 110.832 -179.939 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . 0.547 ' H ' ' HA ' ' A' ' 149' ' ' PHE . . . -54.13 -17.68 8.07 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.783 -0.722 . . . . 74.24 112.461 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . 0.534 ' HB2' ' HD2' ' A' ' 149' ' ' PHE . . . -89.36 13.29 13.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.848 0.356 . . . . 75.03 111.159 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . 0.451 ' HB3' ' HB1' ' A' ' 139' ' ' ALA . 5.0 p80 -81.09 0.91 33.96 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.191 -0.458 . . . . 71.11 110.859 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 104.61 47.1 1.23 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.828 -0.701 . . . . 45.51 112.521 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -159.46 174.21 15.03 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.795 0.331 . . . . 72.14 110.885 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 57.7 m -63.98 176.42 0.97 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.227 -0.442 . . . . 51.25 110.848 -179.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 64.91 121.39 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.599 0.714 . . . . 73.4 110.908 -179.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.82 151.29 68.67 Favored 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.627 2.218 . . . . 74.53 112.335 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 149' ' ' PHE . . . . . 0.547 ' HA ' ' H ' ' A' ' 141' ' ' GLY . 1.5 p90 -53.93 -30.22 45.51 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.192 -0.458 . . . . 63.52 110.931 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . 0.518 ' CG ' ' O ' ' A' ' 149' ' ' PHE . 2.9 p30 50.03 15.45 0.18 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.135 -0.484 . . . . 63.11 110.851 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . 0.407 ' C ' ' O ' ' A' ' 150' ' ' ASP . . . 37.5 -154.64 0.01 OUTLIER Glycine 0 N--CA 1.453 -0.228 0 C-N-CA 120.698 -0.763 . . . . 71.41 112.518 -179.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 143.51 51.25 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.627 2.218 . . . . 75.11 112.389 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . 0.448 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 105.0 -132.14 10.96 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.809 -0.71 . . . . 70.32 112.493 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 154' ' ' ASN . . . . . 0.448 ' C ' ' O ' ' A' ' 153' ' ' GLY . 2.7 p30 -34.62 142.51 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.954 0.407 . . . . 73.25 110.907 -179.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 155' ' ' THR . . . . . 0.594 HG22 ' HA3' ' A' ' 68' ' ' GLY . 0.3 OUTLIER 69.59 110.06 0.05 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.21 -0.45 . . . . 44.41 111.16 -179.921 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . 0.985 HD21 HG21 ' A' ' 186' ' ' ILE . 0.6 OUTLIER -87.97 -54.5 4.2 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.15 -0.477 . . . . 75.02 110.947 179.965 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . 0.575 ' HB1' ' O ' ' A' ' 171' ' ' HIS . . . -163.84 149.18 10.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.209 -0.451 . . . . 71.42 111.092 179.805 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 33.9 p-80 -108.1 123.36 48.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.2 -0.455 . . . . 72.02 110.771 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.45 ' H ' HG22 ' A' ' 69' ' ' VAL . . . -111.05 160.23 17.04 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.154 -0.475 . . . . 74.42 111.152 179.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -110.89 150.77 28.71 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.285 -0.416 . . . . 75.31 110.892 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . 0.624 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -79.26 162.1 65.27 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.607 0.718 . . . . 61.04 111.116 179.915 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 162' ' ' PRO . . . . . 0.624 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.5 Cg_endo -69.74 77.82 1.04 Allowed 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.704 2.269 . . . . 74.44 112.315 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -135.18 121.5 2.59 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.697 -0.763 . . . . 61.41 112.52 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 62.61 -173.64 0.15 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.817 0.342 . . . . 73.1 111.144 -179.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -79.09 -49.79 6.17 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.815 -0.707 . . . . 74.03 112.527 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 166' ' ' LEU . . . . . 0.585 HD23 ' O ' ' A' ' 166' ' ' LEU . 6.1 tt -63.78 -37.17 86.37 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.863 0.363 . . . . 65.12 110.874 -179.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -79.18 157.5 42.97 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.725 -0.75 . . . . 43.43 112.454 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 94.42 22.9 23.22 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.719 -0.753 . . . . 74.31 112.542 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 80.6 m-20 -94.4 168.49 10.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.877 0.37 . . . . 63.41 110.789 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -117.11 130.83 56.89 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.124 -0.489 . . . . 74.21 111.042 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 171' ' ' HIS . . . . . 0.575 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 28.1 m170 -126.11 132.14 51.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.2 -0.454 . . . . 72.53 110.85 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 32.3 m-85 -113.75 139.97 48.66 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.214 -0.448 . . . . 71.44 110.876 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 55.3 t0 -71.56 100.25 2.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.112 -0.494 . . . . 74.11 110.831 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.62 -16.53 10.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.227 -0.442 . . . . 72.25 110.823 -179.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -78.46 -16.19 57.81 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.208 -0.451 . . . . 73.32 110.806 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -83.59 -174.54 5.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.255 -0.43 . . . . 63.2 110.969 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 12.9 mtm180 -113.23 116.95 30.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.207 -0.451 . . . . 63.14 110.907 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 44.2 m95 -116.86 137.44 52.21 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.235 -0.439 . . . . 72.31 110.897 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 179' ' ' THR . . . . . 0.567 HG21 ' HB3' ' A' ' 182' ' ' SER . 5.0 t -176.58 163.69 2.42 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.219 -0.446 . . . . 74.13 111.143 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -123.99 -68.69 0.85 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.204 -0.453 . . . . 45.33 110.842 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -66.8 -10.84 56.46 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.755 -0.736 . . . . 62.41 112.492 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 182' ' ' SER . . . . . 0.567 ' HB3' HG21 ' A' ' 179' ' ' THR . 0.3 OUTLIER -96.59 -24.32 16.09 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.912 0.387 . . . . 64.5 110.915 -179.781 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 183' ' ' SER . . . . . 0.448 ' C ' ' O ' ' A' ' 182' ' ' SER . 97.4 p 34.02 63.3 0.41 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.131 -0.486 . . . . 64.12 110.825 -179.9 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 24.8 tp -116.91 -33.64 4.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.18 -0.464 . . . . 74.2 110.889 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -124.51 -135.76 4.49 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.699 -0.762 . . . . 73.01 112.484 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 186' ' ' ILE . . . . . 0.985 HG21 HD21 ' A' ' 156' ' ' LEU . 7.1 mm -79.36 100.09 3.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.775 0.322 . . . . 73.22 111.162 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -50.75 123.79 9.72 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.131 -0.486 . . . . 71.31 110.816 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 188' ' ' PHE . . . . . 0.772 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.6 t80 -54.03 -35.42 61.94 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.121 -0.49 . . . . 75.45 110.873 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . 0.565 HD12 ' HE2' ' A' ' 224' ' ' PHE . 0.2 OUTLIER -67.27 -47.11 71.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.122 -0.49 . . . . 52.02 110.955 179.964 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.16 -40.86 77.92 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.234 -0.439 . . . . 74.22 110.934 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 191' ' ' ALA . . . . . 0.602 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -70.16 -35.05 73.73 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.128 -0.487 . . . . 50.03 111.079 179.847 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 192' ' ' ALA . . . . . 0.707 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -56.81 -43.24 80.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.216 -0.447 . . . . 52.11 111.102 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 193' ' ' THR . . . . . 0.504 HG21 HG21 ' A' ' 211' ' ' VAL . 0.0 OUTLIER -57.86 -42.63 84.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.21 -0.45 . . . . 72.43 111.117 -179.891 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 5.7 t-160 -73.46 -40.23 64.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.182 -0.463 . . . . 71.44 110.905 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -70.69 -48.85 52.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.139 -0.482 . . . . 71.01 111.059 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 196' ' ' LEU . . . . . 0.707 HD23 ' O ' ' A' ' 192' ' ' ALA . 4.2 mm? -64.04 -46.6 83.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 74.51 110.939 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -55.06 -31.97 56.36 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.74 -0.743 . . . . 52.23 112.429 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 198' ' ' HIS . . . . . 0.694 ' CD2' HG21 ' A' ' 69' ' ' VAL . 4.5 m-70 -65.54 -36.42 83.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.855 0.36 . . . . 75.21 110.826 -179.898 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 29.9 t -67.38 -21.05 65.63 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.187 -0.46 . . . . 71.13 110.871 -179.755 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -90.31 -0.07 57.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.141 -0.482 . . . . 64.13 110.935 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 85.01 -7.89 72.83 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.692 -0.766 . . . . 50.41 112.449 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 202' ' ' MET . . . . . . . . . . . . . 28.3 tpp -50.05 139.36 14.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.797 0.332 . . . . 63.21 110.966 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -101.17 159.08 18.85 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.776 -0.726 . . . . 64.44 112.535 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 204' ' ' HIS . . . . . 0.407 ' HA ' ' HB3' ' A' ' 212' ' ' MET . 22.5 m-70 -56.99 154.81 9.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.791 0.329 . . . . 74.32 110.851 -179.901 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -119.3 145.05 46.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.234 -0.439 . . . . 53.34 110.852 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 206' ' ' SER . . . . . 0.457 ' HB3' ' HA2' ' A' ' 47' ' ' GLY . 1.7 m -87.97 -4.26 58.83 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.155 -0.475 . . . . 72.22 110.805 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 207' ' ' ASP . . . . . 0.411 ' HB2' ' HB2' ' A' ' 210' ' ' ALA . 0.6 OUTLIER -71.38 137.7 83.85 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.635 0.731 . . . . 65.11 110.835 179.998 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -69.71 -9.84 27.11 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.704 2.269 . . . . 74.53 112.368 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 -122.01 24.72 9.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.145 -0.479 . . . . 63.52 110.858 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 210' ' ' ALA . . . . . 0.439 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.33 145.17 26.44 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.185 -0.461 . . . . 62.23 111.092 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 211' ' ' VAL . . . . . 0.504 HG21 HG21 ' A' ' 193' ' ' THR . 0.3 OUTLIER -69.5 -27.71 35.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.185 -0.461 . . . . 62.04 111.163 179.925 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 212' ' ' MET . . . . . 0.407 ' HB3' ' HA ' ' A' ' 204' ' ' HIS . 0.0 OUTLIER -92.1 3.65 54.83 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.205 -0.452 . . . . 75.22 110.841 179.935 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 213' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -55.54 110.43 2.25 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-O 121.652 0.739 . . . . 73.43 110.934 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 -18.07 37.17 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.685 2.257 . . . . 63.01 112.31 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -84.11 58.1 4.57 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.247 -0.433 . . . . 74.24 111.136 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -51.48 128.32 22.53 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.246 -0.434 . . . . 74.14 110.907 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . 147.19 52.13 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.759 -0.734 . . . . 74.22 112.489 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 7.5 p30 -122.83 -177.61 3.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.827 0.346 . . . . 64.22 110.921 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . -51.85 157.16 3.4 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.742 -0.742 . . . . 72.24 112.498 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 220' ' ' ASP . . . . . 0.403 ' HA ' ' HD2' ' A' ' 221' ' ' PRO . 0.7 OUTLIER -102.58 101.44 20.27 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-O 121.589 0.709 . . . . 41.43 110.883 -179.991 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 221' ' ' PRO . . . . . 0.403 ' HD2' ' HA ' ' A' ' 220' ' ' ASP . 53.8 Cg_endo -69.81 168.56 21.27 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.7 2.266 . . . . 73.42 112.326 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -75.12 -44.91 44.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.236 -0.438 . . . . 74.21 110.954 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -126.77 -39.99 1.94 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.176 -0.465 . . . . 60.33 110.952 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 224' ' ' PHE . . . . . 0.565 ' HE2' HD12 ' A' ' 189' ' ' LEU . 0.0 OUTLIER 66.08 137.59 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.162 -0.472 . . . . 65.01 110.922 -179.997 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -143.23 -167.74 2.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.109 -0.496 . . . . 64.24 110.905 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . 0.883 HD23 ' HB3' ' A' ' 115' ' ' MET . 0.5 OUTLIER -59.3 148.67 31.32 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.208 -0.451 . . . . 53.44 110.902 179.935 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 227' ' ' SER . . . . . 0.439 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 2.0 t -87.12 157.4 19.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.192 -0.458 . . . . 74.21 110.926 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -63.44 -63.07 1.28 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.12 -0.491 . . . . 74.54 110.871 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -55.74 -27.77 52.4 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.212 -0.449 . . . . 72.22 110.897 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.22 -48.51 61.76 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.275 -0.42 . . . . 74.23 110.805 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 231' ' ' ILE . . . . . 0.665 HD11 ' HB3' ' A' ' 226' ' ' LEU . 8.3 mt -68.23 -43.07 84.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.213 -0.449 . . . . 73.41 111.1 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 11.8 pttp -66.09 -33.03 74.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.157 -0.474 . . . . 65.42 110.91 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -63.18 -46.78 92.41 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.784 -0.722 . . . . 63.43 112.435 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 7.0 tt -72.9 -30.77 33.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.74 0.305 . . . . 71.54 111.066 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -65.87 -24.3 66.84 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.214 -0.448 . . . . 70.33 110.862 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 236' ' ' LYS . . . . . 0.405 ' HE2' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.64 -28.29 60.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.259 -0.428 . . . . 51.21 110.913 179.992 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 237' ' ' LEU . . . . . 0.844 HD22 ' HD2' ' A' ' 83' ' ' LYS . 7.0 tt -97.77 -31.0 12.46 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.2 -0.455 . . . . 75.41 110.892 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 238' ' ' TYR . . . . . 0.417 ' OH ' HD11 ' A' ' 122' ' ' LEU . 3.7 m-85 -91.85 -35.21 14.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.19 -0.459 . . . . 51.24 110.875 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -127.41 -120.17 2.31 Favored Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.691 -0.766 . . . . 32.22 112.453 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 2.0 mttm -98.07 144.91 27.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.842 0.353 . . . . 75.42 110.841 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.57 168.95 11.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.231 -0.441 . . . . 73.34 110.926 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -140.48 -43.12 0.41 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.28 -0.418 . . . . 62.42 110.868 -179.845 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -165.6 123.23 1.51 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.184 -0.462 . . . . 72.13 110.886 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -54.23 172.59 0.09 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.13 -0.486 . . . . 62.23 110.879 -179.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -164.89 163.02 21.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.155 -0.475 . . . . 70.43 110.881 -179.862 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.76 163.07 20.42 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.197 -0.456 . . . . 72.11 110.892 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 1.5 ptpt . . . . . 0 C--N 1.33 -0.267 0 CA-C-N 116.167 -0.47 . . . . 74.13 110.827 179.902 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 302' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' -2' ' ' LEU . . . . . 0.489 ' N ' ' HD2' ' A' ' -1' ' ' PRO . 2.3 mt . . . . . 0 C--O 1.232 0.136 0 CA-C-O 121.594 0.711 . . . . 73.02 110.889 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' -1' ' ' PRO . . . . . 0.489 ' HD2' ' N ' ' A' ' -2' ' ' LEU . 53.0 Cg_endo -69.87 96.11 0.59 Allowed 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.635 2.224 . . . . 71.15 112.288 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 0' ' ' LEU . . . . . 0.49 ' N ' ' HD2' ' A' ' 1' ' ' PRO . 0.3 OUTLIER -68.58 -60.43 4.72 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.587 0.708 . . . . 62.13 110.888 179.972 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.49 ' HD2' ' N ' ' A' ' 0' ' ' LEU . 53.4 Cg_endo -69.75 -176.39 1.47 Allowed 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.694 2.263 . . . . 64.14 112.31 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -113.98 130.31 56.54 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.236 -0.438 . . . . 60.51 110.926 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -95.12 -25.27 16.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.142 -0.481 . . . . 74.01 110.891 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.58 -34.05 66.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.142 -0.481 . . . . 71.4 111.094 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -55.76 -37.98 71.23 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.746 -0.74 . . . . 60.51 112.532 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -108.94 20.89 28.35 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.754 -0.736 . . . . 54.22 112.475 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 7.5 mtt -82.9 161.32 21.9 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.771 0.32 . . . . 72.23 110.908 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.3 p -115.57 168.65 9.82 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.25 -0.432 . . . . 73.24 110.819 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -54.36 -31.87 55.59 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.103 -0.498 . . . . 50.12 110.916 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.79 -42.74 97.69 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.151 -0.477 . . . . 72.33 110.862 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -63.02 -42.2 99.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.231 -0.44 . . . . 72.14 110.925 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 3.4 t-105 -72.94 -37.16 67.25 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.159 -0.473 . . . . 71.22 110.917 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 41.1 mm-40 -71.17 -35.49 71.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.271 -0.422 . . . . 72.51 110.926 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 5.8 mm-40 -68.85 -37.13 78.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.098 -0.501 . . . . 61.24 110.88 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.459 ' HB1' ' HE3' ' A' ' 62' ' ' MET . . . -57.21 -36.95 71.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.2 -0.454 . . . . 54.34 111.059 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.656 ' NE2' HD22 ' A' ' 35' ' ' LEU . 10.6 tt0 -69.87 -42.96 72.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.21 -0.45 . . . . 73.12 110.931 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.413 ' HA ' ' HD2' ' A' ' 20' ' ' LYS . 35.6 m-20 -65.21 -31.56 72.79 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.46 . . . . 72.4 110.808 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 17.5 m-85 -70.42 -36.6 74.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.214 -0.448 . . . . 75.11 110.979 -179.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.634 HD13 ' O ' ' A' ' 19' ' ' LEU . 3.2 tm? -72.01 -26.32 62.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.063 -0.517 . . . . 72.51 110.923 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.413 ' HD2' ' HA ' ' A' ' 17' ' ' ASP . 5.0 ptmt -67.6 -32.18 72.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.175 -0.466 . . . . 74.41 110.882 179.86 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.8 ptp85 -85.91 -26.74 25.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.251 -0.432 . . . . 74.05 110.82 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -74.51 2.36 9.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.255 -0.429 . . . . 74.31 110.868 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.549 ' CE1' HD12 ' A' ' 24' ' ' LEU . 60.3 t80 -118.26 -75.93 0.58 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.154 -0.475 . . . . 72.55 110.947 -179.818 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.549 HD12 ' CE1' ' A' ' 23' ' ' TYR . 95.1 mt -156.7 22.11 0.33 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.067 -0.515 . . . . 75.43 110.912 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 4.3 t80 49.48 89.69 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.277 -0.42 . . . . 71.41 110.945 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -125.25 115.28 20.13 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.051 -0.522 . . . . 74.25 110.842 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 58.5 p -83.58 -6.56 59.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.261 -0.427 . . . . 62.15 110.845 -179.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -91.69 -22.58 20.16 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.186 -0.461 . . . . 74.51 110.908 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.721 HG21 ' HD3' ' A' ' 38' ' ' LYS . 11.7 m -76.92 -18.77 58.07 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.124 -0.489 . . . . 70.44 111.143 -179.885 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.29 100.65 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.24 -0.436 . . . . 73.33 110.898 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -179.23 155.15 0.7 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 64.43 110.887 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.98 -33.87 70.85 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.179 -0.464 . . . . 70.21 111.128 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 16.4 m-20 -67.85 -40.19 83.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.161 -0.472 . . . . 35.31 110.897 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 5.1 m -86.12 -20.09 29.2 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.149 -0.478 . . . . 74.02 110.881 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.656 HD22 ' NE2' ' A' ' 16' ' ' GLN . 31.1 tp -58.01 -45.19 87.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.089 -0.505 . . . . 72.52 110.861 -179.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -57.64 -46.06 84.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.295 -0.412 . . . . 73.13 110.821 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.56 -36.68 84.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.133 -0.485 . . . . 63.32 111.108 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.721 ' HD3' HG21 ' A' ' 29' ' ' THR . 11.8 mtmt -70.38 -49.31 50.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.171 -0.468 . . . . 72.32 110.845 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.487 HD11 HD22 ' A' ' 54' ' ' LEU . 5.1 mt -59.79 -35.77 75.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.287 -0.415 . . . . 72.11 110.881 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.1 ttmt -58.15 -46.25 85.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.198 -0.455 . . . . 62.43 110.912 179.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -70.37 -36.4 74.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 75.11 110.869 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.9 ttp -69.4 -36.48 76.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.173 -0.467 . . . . 63.43 110.849 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.597 ' HG2' HD11 ' A' ' 48' ' ' LEU . 3.2 mt-30 -66.91 -43.34 83.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.166 -0.47 . . . . 74.45 110.987 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.558 ' HD2' ' N ' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -73.11 -20.83 60.85 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.191 -0.459 . . . . 71.43 110.921 179.886 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.558 ' N ' ' HD2' ' A' ' 44' ' ' LYS . 89.1 t80 -71.22 -37.6 72.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.241 -0.436 . . . . 73.32 110.945 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.833 ' CZ ' HD13 ' A' ' 61' ' ' ILE . 6.1 m-85 -81.91 -28.4 32.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.109 -0.496 . . . . 70.43 110.841 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 106.45 -10.44 42.48 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.723 -0.751 . . . . 64.34 112.538 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.597 HD11 ' HG2' ' A' ' 43' ' ' GLN . 0.9 OUTLIER -63.47 138.61 97.41 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.65 0.738 . . . . 64.11 110.863 -179.858 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.84 -54.04 0.24 Allowed 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.664 2.243 . . . . 74.5 112.38 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.689 HD11 ' HB3' ' A' ' 57' ' ' ARG . 0.7 OUTLIER -50.08 107.97 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.24 -0.436 . . . . 71.22 111.074 179.931 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 3.6 p -111.0 167.07 10.53 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.197 -0.456 . . . . 73.25 111.174 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 57.68 19.59 35.99 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.739 -0.743 . . . . 64.24 112.538 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.1 mtt -119.55 161.09 21.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.795 0.331 . . . . 75.23 110.883 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.487 HD22 HD11 ' A' ' 39' ' ' LEU . 26.2 tp -164.35 85.38 0.44 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.27 -0.423 . . . . 73.4 110.99 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.424 ' HA ' HG13 ' A' ' 59' ' ' ILE . 0.5 OUTLIER 175.52 -29.17 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.188 -0.46 . . . . 44.35 110.86 179.907 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 23.5 m -89.77 -101.29 0.1 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.235 -0.439 . . . . 75.25 110.811 -179.826 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.689 ' HB3' HD11 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -84.79 -28.54 26.09 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.125 -0.489 . . . . 61.22 110.927 -179.944 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.654 HG23 HD12 ' A' ' 50' ' ' ILE . 43.6 t -64.63 -42.69 95.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.125 -0.489 . . . . 70.12 111.12 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.424 HG13 ' HA ' ' A' ' 55' ' ' ASN . 1.5 mm -74.61 -31.43 27.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.161 -0.472 . . . . 74.43 111.127 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -58.97 -40.16 83.93 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.15 -0.477 . . . . 73.45 110.913 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.833 HD13 ' CZ ' ' A' ' 46' ' ' PHE . 1.2 pp -68.17 -28.98 42.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.088 -0.505 . . . . 74.52 111.124 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.459 ' HE3' ' HB1' ' A' ' 15' ' ' ALA . 3.3 mmt -60.54 -40.19 90.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.182 -0.463 . . . . 74.01 110.891 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -84.46 -23.76 29.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.219 -0.446 . . . . 42.22 110.892 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.37 112.1 41.59 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.533 0.682 . . . . 65.34 110.873 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 151.8 69.12 Favored 'Trans proline' 0 N--CA 1.465 -0.188 0 C-N-CA 122.707 2.271 . . . . 72.11 112.367 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -145.75 -68.84 0.28 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.217 -0.447 . . . . 71.51 110.843 -179.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -145.21 151.89 39.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.243 -0.435 . . . . 55.3 110.889 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.652 ' HA2' HG23 ' A' ' 155' ' ' THR . . . -88.02 4.27 85.59 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.742 -0.742 . . . . 64.23 112.495 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.49 HG21 ' CD2' ' A' ' 198' ' ' HIS . 0.2 OUTLIER -92.89 135.24 26.28 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.645 0.735 . . . . 74.23 111.111 -179.912 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.486 ' HD2' HG12 ' A' ' 69' ' ' VAL . 53.6 Cg_endo -69.78 151.93 69.1 Favored 'Trans proline' 0 C--O 1.231 0.143 0 C-N-CA 122.679 2.253 . . . . 63.44 112.321 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -58.91 -30.86 68.13 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.166 -0.47 . . . . 74.45 110.864 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.544 HG11 ' CE2' ' A' ' 23' ' ' TYR . 8.9 m -110.91 129.13 66.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.208 -0.451 . . . . 53.43 111.111 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -130.84 170.42 14.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.203 -0.453 . . . . 73.13 111.17 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -172.59 154.93 3.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.283 -0.417 . . . . 73.31 110.889 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -170.25 165.34 9.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.157 -0.474 . . . . 70.41 110.884 -179.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -51.84 160.29 0.71 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.111 -0.495 . . . . 74.2 110.804 -179.811 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.3 tp -95.41 32.82 1.69 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.064 -0.516 . . . . 70.34 110.903 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . 0.489 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 0.7 OUTLIER -68.88 -60.62 4.25 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.588 0.709 . . . . 71.24 110.861 179.95 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.489 ' HD2' ' N ' ' A' ' 78' ' ' PHE . 53.4 Cg_endo -69.72 117.36 5.03 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.681 2.254 . . . . 73.34 112.33 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -51.52 123.13 9.19 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.24 -0.437 . . . . 74.43 110.932 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 63.48 155.64 0.12 Allowed Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.628 0.728 . . . . 70.4 110.902 -179.815 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 -49.28 0.58 Allowed 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.688 2.259 . . . . 71.11 112.319 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.644 ' HD2' HD22 ' A' ' 237' ' ' LEU . 20.4 mttp -78.31 161.16 27.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.263 -0.426 . . . . 64.45 110.849 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . 0.432 ' CD1' ' HA ' ' A' ' 200' ' ' LEU . 27.2 m95 -49.88 116.42 1.8 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.217 -0.447 . . . . 73.31 110.906 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.434 HG22 ' O ' ' A' ' 85' ' ' THR . 6.4 m -115.17 1.05 13.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.262 -0.427 . . . . 65.3 111.132 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.8 m -66.33 -176.61 0.45 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.197 -0.456 . . . . 70.34 110.842 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 4.0 mttt -92.07 -23.08 19.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.102 -0.499 . . . . 71.12 110.94 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -154.29 143.49 13.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.226 -0.443 . . . . 74.14 111.064 179.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 99.6 t -117.81 130.36 72.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.142 -0.481 . . . . 72.25 111.119 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.644 HG22 ' HB3' ' A' ' 125' ' ' ARG . 28.8 p -122.09 162.34 21.42 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.16 -0.473 . . . . 71.01 111.157 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 4.0 p90 -151.24 146.59 26.17 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.223 -0.444 . . . . 70.51 110.932 -179.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 10.4 ttt180 -148.36 135.88 20.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.124 -0.489 . . . . 71.25 110.899 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.405 HG13 ' HB ' ' A' ' 136' ' ' ILE . 3.9 mp -74.82 135.46 27.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.205 -0.452 . . . . 72.4 111.173 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.417 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 19.9 t -90.33 -40.48 12.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.19 -0.459 . . . . 60.2 111.105 179.909 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 40.9 t -144.16 164.45 30.65 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.174 -0.466 . . . . 64.24 110.863 -179.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 6.1 p90 -111.47 153.41 26.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.159 -0.473 . . . . 72.25 110.958 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.486 ' OG1' HG21 ' A' ' 105' ' ' VAL . 0.2 OUTLIER -82.61 140.97 32.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.128 -0.487 . . . . 64.11 111.136 -179.949 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 10.8 ptp180 -73.21 -7.88 53.38 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.214 -0.448 . . . . 72.14 110.893 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -96.42 -26.05 15.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.232 -0.44 . . . . 74.13 110.927 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.614 HD21 ' HA ' ' A' ' 179' ' ' THR . 0.5 OUTLIER -133.55 153.75 80.44 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.57 0.7 . . . . 72.52 110.928 -179.936 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . 0.603 ' HB2' HG22 ' A' ' 103' ' ' ILE . 54.5 Cg_endo -69.7 150.9 69.16 Favored 'Trans proline' 0 N--CA 1.465 -0.187 0 C-N-CA 122.744 2.296 . . . . 73.11 112.359 179.825 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 16.3 t-160 -53.22 -25.79 15.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.304 -0.407 . . . . 74.11 110.817 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.603 HG22 ' HB2' ' A' ' 101' ' ' PRO . 15.2 tt -76.62 -39.15 31.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.449 . . . . 74.02 111.119 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . 0.664 ' O ' HD22 ' A' ' 108' ' ' LEU . 3.3 m -69.2 -38.91 78.86 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.166 -0.47 . . . . 52.11 111.157 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.733 ' O ' HG13 ' A' ' 109' ' ' VAL . 97.3 t -72.72 -44.85 58.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.172 -0.467 . . . . 71.51 111.111 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.685 ' O ' HG22 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -66.27 -41.79 89.39 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.257 -0.429 . . . . 63.44 110.851 179.893 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -70.04 -34.23 72.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 75.02 110.909 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.664 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -61.05 -48.1 83.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.162 -0.472 . . . . 71.04 110.935 -179.991 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.733 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.4 m -55.37 -41.37 61.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.218 -0.446 . . . . 72.31 111.095 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.463 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 32.1 t -70.08 -33.8 72.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.17 -0.468 . . . . 72.14 110.894 -179.807 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.41 ' CG ' HD21 ' A' ' 189' ' ' LEU . 0.3 OUTLIER -62.28 -33.26 74.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.09 -0.504 . . . . 74.35 110.873 179.951 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -95.68 -40.53 9.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.219 -0.446 . . . . 74.32 111.114 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.722 ' CD1' HD12 ' A' ' 196' ' ' LEU . 0.4 OUTLIER -65.32 -32.8 74.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.263 -0.426 . . . . 72.0 110.954 -179.984 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 15.4 t30 -65.49 -39.85 92.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.172 -0.467 . . . . 72.34 110.887 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . 0.777 ' O ' HD11 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -59.85 -34.95 73.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.107 -0.497 . . . . 54.12 110.868 179.951 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' TRP . . . . . 0.429 ' CG ' HD11 ' A' ' 200' ' ' LEU . 28.2 m95 -66.59 -52.28 47.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.282 -0.417 . . . . 75.23 110.947 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -60.13 -36.17 89.79 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.754 -0.736 . . . . 73.32 112.45 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.3 mmpt? -64.67 -14.09 56.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.724 0.297 . . . . 72.42 110.95 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.457 ' HG2' HG23 ' A' ' 120' ' ' ILE . 0.6 OUTLIER -99.11 -13.81 19.64 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.226 -0.443 . . . . 75.24 110.873 179.974 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 1.12 HD12 HD12 ' A' ' 122' ' ' LEU . 6.9 pt -122.79 142.92 38.95 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.619 0.723 . . . . 71.34 111.121 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.8 8.54 0.75 Allowed 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.708 2.272 . . . . 72.21 112.364 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 1.12 HD12 HD12 ' A' ' 120' ' ' ILE . 16.4 mt -61.26 -163.17 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.216 -0.447 . . . . 73.22 110.938 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.401 ' H ' ' HB3' ' A' ' 122' ' ' LEU . 3.3 t60 -144.87 122.98 12.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.196 -0.457 . . . . 74.12 110.861 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 9.2 m-30 -107.49 141.47 38.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 75.54 110.86 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.644 ' HB3' HG22 ' A' ' 90' ' ' THR . 0.0 OUTLIER -125.93 141.63 51.88 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.164 -0.471 . . . . 75.14 110.911 -179.931 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.85 152.5 28.15 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.263 -0.426 . . . . 72.22 110.876 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . 0.893 HG11 ' HB2' ' A' ' 132' ' ' ALA . 29.3 m -103.17 126.24 57.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.176 -0.466 . . . . 50.13 111.137 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.606 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -144.9 -11.08 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.151 -0.477 . . . . 74.43 111.126 179.994 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' TRP . . . . . 0.606 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -157.0 109.24 2.46 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.166 -0.47 . . . . 71.25 110.869 -179.996 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 108.22 -162.49 13.06 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.726 -0.749 . . . . 62.11 112.505 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.88 156.35 17.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.79 0.328 . . . . 63.25 111.132 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . 0.893 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -111.62 165.28 12.15 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.196 -0.456 . . . . 51.34 111.109 179.852 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -73.41 -55.1 6.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 75.41 110.819 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . 0.439 HD12 ' N ' ' A' ' 134' ' ' ILE . 4.8 mp -92.68 107.48 19.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.205 -0.452 . . . . 70.51 111.143 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . 0.417 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 14.0 mmm -91.54 128.18 37.27 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.207 -0.451 . . . . 72.43 110.887 179.849 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.405 ' HB ' HG13 ' A' ' 93' ' ' ILE . 0.6 OUTLIER -106.13 94.74 3.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.263 -0.426 . . . . 70.04 111.098 179.976 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -134.59 160.56 24.27 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.732 -0.747 . . . . 63.34 112.47 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' PHE . . . . . 0.571 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 49.2 m-85 -105.08 149.53 25.76 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.82 0.343 . . . . 74.01 110.912 -179.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.571 ' HB2' ' O ' ' A' ' 138' ' ' PHE . . . 169.43 166.83 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.203 -0.453 . . . . 71.21 111.074 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -104.44 173.27 6.38 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.189 -0.459 . . . . 62.21 110.928 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -55.36 -17.1 11.2 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.72 -0.753 . . . . 74.24 112.524 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -88.3 12.93 12.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.829 0.347 . . . . 75.03 111.109 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 5.9 p80 -80.67 -22.11 40.73 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.184 -0.462 . . . . 71.11 110.939 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 139.34 38.7 0.1 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.808 -0.71 . . . . 45.51 112.495 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 54.1 p-10 -150.18 152.01 33.98 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.823 0.344 . . . . 72.14 110.869 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 96.0 p -73.4 -179.74 3.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.175 -0.466 . . . . 51.25 110.861 -179.747 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 68.6 121.08 0.03 OUTLIER Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.659 0.742 . . . . 73.4 110.897 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.75 144.88 55.52 Favored 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 122.665 2.243 . . . . 74.53 112.391 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 149' ' ' PHE . . . . . 0.424 ' CE1' ' HB2' ' A' ' 173' ' ' ASP . 0.1 OUTLIER -90.89 -32.78 15.89 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.182 -0.463 . . . . 63.52 110.926 -179.975 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 73.88 -1.26 3.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.158 -0.474 . . . . 63.11 110.859 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . 0.641 ' O ' 'CA ' ' A' ' 302' ' ' ' CA' . . . 49.58 -108.37 0.44 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.809 -0.71 . . . . 71.41 112.504 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.84 139.61 40.37 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.58 2.186 . . . . 75.11 112.419 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 103.23 -155.16 18.08 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.745 -0.741 . . . . 70.32 112.497 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 154' ' ' ASN . . . . . 0.436 ' O ' ' CB ' ' A' ' 155' ' ' THR . 2.9 p30 -42.06 153.75 0.06 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.989 0.423 . . . . 73.25 110.857 -179.834 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 155' ' ' THR . . . . . 0.652 HG23 ' HA2' ' A' ' 68' ' ' GLY . 1.2 m 80.15 114.53 0.06 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.149 -0.478 . . . . 44.41 111.155 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . 1.085 HD21 HG21 ' A' ' 186' ' ' ILE . 0.7 OUTLIER -99.72 -51.64 3.68 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.255 -0.43 . . . . 75.02 110.984 179.928 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . 0.552 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -163.4 148.11 11.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.176 -0.465 . . . . 71.42 111.12 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 21.3 p-80 -108.13 124.92 50.98 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.257 -0.428 . . . . 72.02 110.873 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.446 ' H ' HG22 ' A' ' 69' ' ' VAL . . . -110.73 156.26 21.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.239 -0.437 . . . . 74.42 111.065 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 13.0 m-30 -117.05 150.89 37.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.208 -0.451 . . . . 75.31 110.864 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . 0.71 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -79.87 164.55 52.52 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 121.591 0.71 . . . . 61.04 111.078 179.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 162' ' ' PRO . . . . . 0.71 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.7 Cg_endo -69.76 78.38 1.01 Allowed 'Trans proline' 0 C--N 1.341 0.156 0 C-N-CA 122.707 2.271 . . . . 74.44 112.316 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -140.29 128.55 3.88 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.722 -0.752 . . . . 61.41 112.507 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 64.64 -169.96 0.2 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.848 0.356 . . . . 73.1 111.113 -179.87 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -85.63 -49.86 4.2 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.727 -0.749 . . . . 74.03 112.483 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 166' ' ' LEU . . . . . 0.648 HD23 ' O ' ' A' ' 166' ' ' LEU . 8.2 tt -68.14 -27.52 66.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.869 0.366 . . . . 65.12 110.947 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -84.04 159.92 36.34 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.801 -0.714 . . . . 43.43 112.467 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 88.26 23.07 38.69 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.766 -0.731 . . . . 74.31 112.498 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 -101.14 164.4 11.81 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.862 0.363 . . . . 63.41 110.83 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.13 130.44 55.9 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.16 -0.473 . . . . 74.21 111.118 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 171' ' ' HIS . . . . . 0.439 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 21.2 m170 -125.9 158.54 34.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.242 -0.435 . . . . 72.53 110.81 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -139.45 139.09 36.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.176 -0.466 . . . . 71.44 110.898 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 173' ' ' ASP . . . . . 0.424 ' HB2' ' CE1' ' A' ' 149' ' ' PHE . 67.1 t0 -67.65 97.61 0.63 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.165 -0.47 . . . . 74.11 110.863 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.05 -16.05 11.44 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.137 -0.483 . . . . 72.25 110.905 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -79.16 -16.42 56.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.135 -0.484 . . . . 73.32 110.832 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 37.2 mm-40 -83.17 -173.66 4.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.158 -0.474 . . . . 63.2 110.927 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 78.7 mtt180 -110.33 110.92 21.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.222 -0.445 . . . . 63.14 110.935 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 68.1 m95 -110.86 134.39 52.58 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.196 -0.456 . . . . 72.31 110.957 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 179' ' ' THR . . . . . 0.614 ' HA ' HD21 ' A' ' 100' ' ' LEU . 7.4 t -177.28 163.62 2.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.225 -0.443 . . . . 74.13 111.077 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -125.22 -70.25 0.75 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.165 -0.471 . . . . 45.33 110.847 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -63.06 -13.42 48.43 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.804 -0.712 . . . . 62.41 112.529 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 182' ' ' SER . . . . . 0.508 ' HB3' HG21 ' A' ' 179' ' ' THR . 0.3 OUTLIER -93.1 -24.44 18.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.885 0.374 . . . . 64.5 110.89 -179.739 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 183' ' ' SER . . . . . 0.418 ' C ' ' O ' ' A' ' 182' ' ' SER . 89.5 p 36.04 58.53 0.95 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 64.12 110.866 -179.814 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -116.85 -33.48 4.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.154 -0.475 . . . . 74.2 110.894 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -119.52 -138.58 5.76 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.713 -0.756 . . . . 73.01 112.491 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 186' ' ' ILE . . . . . 1.085 HG21 HD21 ' A' ' 156' ' ' LEU . 9.2 mm -79.49 102.98 5.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 120.798 0.332 . . . . 73.22 111.115 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -48.96 119.54 3.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.202 -0.454 . . . . 71.31 110.866 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 188' ' ' PHE . . . . . 0.589 ' HD2' ' HB3' ' A' ' 108' ' ' LEU . 1.3 t80 -53.94 -33.72 57.59 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.172 -0.467 . . . . 75.45 110.914 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . 0.592 HD12 ' CD2' ' A' ' 224' ' ' PHE . 0.1 OUTLIER -67.1 -47.49 71.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.101 -0.499 . . . . 52.02 110.995 179.955 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.42 -42.54 74.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.16 -0.473 . . . . 74.22 110.927 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 191' ' ' ALA . . . . . 0.524 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -68.92 -35.28 76.63 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.125 -0.489 . . . . 50.03 111.124 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 192' ' ' ALA . . . . . 0.655 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -56.84 -43.08 80.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.256 -0.429 . . . . 52.11 111.071 179.886 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 193' ' ' THR . . . . . 0.788 HG21 HG21 ' A' ' 211' ' ' VAL . 0.2 OUTLIER -57.65 -41.45 81.47 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.208 -0.451 . . . . 72.43 111.113 -179.851 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 5.3 t-160 -73.34 -45.62 54.06 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.207 -0.451 . . . . 71.44 110.888 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -67.49 -48.91 65.74 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.157 -0.474 . . . . 71.01 111.057 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 196' ' ' LEU . . . . . 0.722 HD12 ' CD1' ' A' ' 113' ' ' LEU . 4.2 mm? -66.31 -37.36 85.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.293 -0.412 . . . . 74.51 110.924 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 197' ' ' GLY . . . . . 0.405 ' O ' ' HB3' ' A' ' 202' ' ' MET . . . -65.4 -28.49 73.64 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.744 -0.741 . . . . 52.23 112.461 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 198' ' ' HIS . . . . . 0.49 ' CD2' HG21 ' A' ' 69' ' ' VAL . 4.0 m-70 -66.87 -37.9 85.29 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.84 0.352 . . . . 75.21 110.873 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -64.46 -20.92 66.48 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.218 -0.446 . . . . 71.13 110.808 -179.764 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 200' ' ' LEU . . . . . 0.432 ' HA ' ' CD1' ' A' ' 84' ' ' TRP . 0.6 OUTLIER -88.5 0.63 56.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.216 -0.447 . . . . 64.13 110.854 -179.969 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 84.1 -6.34 75.88 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.807 -0.711 . . . . 50.41 112.452 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 202' ' ' MET . . . . . 0.406 ' HE1' ' HB ' ' A' ' 234' ' ' ILE . 36.5 tpp -50.27 139.27 15.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.877 0.37 . . . . 63.21 110.798 -180.0 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -103.26 158.98 17.3 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.751 -0.738 . . . . 64.44 112.438 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 27.3 m-70 -58.22 150.96 20.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.784 0.326 . . . . 74.32 110.881 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -116.39 146.87 42.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.261 -0.427 . . . . 53.34 110.814 -179.754 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 88.7 p -87.96 -4.74 58.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.106 -0.497 . . . . 72.22 110.889 -179.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.64 136.47 83.26 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.61 0.719 . . . . 65.11 110.849 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.75 -8.21 23.02 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.681 2.254 . . . . 74.53 112.417 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -122.92 23.02 9.5 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.16 -0.473 . . . . 63.52 110.948 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 210' ' ' ALA . . . . . 0.444 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.25 145.81 26.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.08 -0.509 . . . . 62.23 111.102 179.841 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 211' ' ' VAL . . . . . 0.788 HG21 HG21 ' A' ' 193' ' ' THR . 0.4 OUTLIER -69.55 -29.01 39.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.229 -0.441 . . . . 62.04 111.132 179.983 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -93.53 10.36 32.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.151 -0.477 . . . . 75.22 110.882 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 213' ' ' TYR . . . . . 0.407 ' HA ' ' HD2' ' A' ' 214' ' ' PRO . 2.3 t80 -55.56 114.68 7.74 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-O 121.699 0.761 . . . . 73.43 110.958 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 214' ' ' PRO . . . . . 0.407 ' HD2' ' HA ' ' A' ' 213' ' ' TYR . 53.5 Cg_endo -69.76 -20.0 35.41 Favored 'Trans proline' 0 C--O 1.232 0.211 0 C-N-CA 122.639 2.226 . . . . 63.01 112.315 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -86.45 49.18 1.75 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.255 -0.43 . . . . 74.24 111.128 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 6.5 t80 -61.69 124.13 19.87 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.251 -0.431 . . . . 74.14 110.937 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -157.27 -122.14 0.7 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.744 -0.741 . . . . 74.22 112.454 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -56.44 177.36 0.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.859 0.361 . . . . 64.22 110.905 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . 71.3 98.81 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.741 -0.742 . . . . 72.24 112.516 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 220' ' ' ASP . . . . . 0.417 ' HA ' ' HD2' ' A' ' 221' ' ' PRO . 0.3 OUTLIER -119.75 101.37 48.22 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-O 121.545 0.688 . . . . 41.43 110.878 -179.93 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 221' ' ' PRO . . . . . 0.417 ' HD2' ' HA ' ' A' ' 220' ' ' ASP . 53.2 Cg_endo -69.82 142.79 48.58 Favored 'Trans proline' 0 C--N 1.341 0.145 0 C-N-CA 122.646 2.231 . . . . 73.42 112.362 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -81.46 -22.83 37.83 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.191 -0.459 . . . . 74.21 110.848 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -125.57 -35.63 2.53 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.284 -0.416 . . . . 60.33 110.861 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 224' ' ' PHE . . . . . 0.592 ' CD2' HD12 ' A' ' 189' ' ' LEU . 0.0 OUTLIER 66.26 143.97 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.178 -0.465 . . . . 65.01 110.866 -179.998 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -143.19 163.01 34.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.165 -0.47 . . . . 64.24 110.941 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . 0.777 HD11 ' O ' ' A' ' 115' ' ' MET . 14.9 mt -61.77 148.99 41.23 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.276 -0.42 . . . . 53.44 110.968 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 227' ' ' SER . . . . . 0.444 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 0.3 OUTLIER -86.95 148.33 25.38 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.237 -0.438 . . . . 74.21 110.787 -179.836 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -60.5 -68.71 0.27 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.14 -0.482 . . . . 74.54 110.935 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.48 -25.42 36.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.217 -0.447 . . . . 72.22 110.828 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -68.89 -48.31 63.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.196 -0.456 . . . . 74.23 110.86 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 231' ' ' ILE . . . . . 0.678 HD11 ' HB3' ' A' ' 226' ' ' LEU . 8.0 mt -68.55 -42.67 83.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.236 -0.438 . . . . 73.41 111.096 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 14.0 ptmt -64.73 -32.38 74.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.242 -0.435 . . . . 65.42 110.889 179.826 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -62.9 -50.07 66.96 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.767 -0.73 . . . . 63.43 112.475 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 234' ' ' ILE . . . . . 0.406 ' HB ' ' HE1' ' A' ' 202' ' ' MET . 0.3 OUTLIER -73.15 -30.5 31.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.862 0.363 . . . . 71.54 111.195 179.98 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 15.3 mt-30 -67.13 -24.28 65.9 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.136 -0.483 . . . . 70.33 110.984 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 236' ' ' LYS . . . . . 0.418 ' HE2' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.09 -26.59 60.45 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.143 -0.481 . . . . 51.21 110.874 179.937 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 237' ' ' LEU . . . . . 0.663 ' O ' HD23 ' A' ' 237' ' ' LEU . 8.1 tt -97.63 -28.94 13.7 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.22 -0.445 . . . . 75.41 110.949 179.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 238' ' ' TYR . . . . . 0.538 ' CE1' HD11 ' A' ' 122' ' ' LEU . 21.4 m-85 -92.11 -35.15 14.05 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.19 -0.459 . . . . 51.24 110.958 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -136.59 -119.74 1.89 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.756 -0.735 . . . . 32.22 112.504 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.56 152.82 20.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.777 0.322 . . . . 75.42 110.866 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 1.3 ptm180 -96.78 -169.71 1.93 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.2 -0.454 . . . . 73.34 110.853 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -173.97 44.54 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.168 -0.469 . . . . 62.42 110.848 -179.796 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 17.1 t-20 63.32 82.14 0.19 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.118 -0.492 . . . . 72.13 110.934 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 22.3 p -173.4 140.46 0.83 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.243 -0.435 . . . . 62.23 110.897 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -178.59 175.98 1.05 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.161 -0.472 . . . . 70.43 110.863 -179.888 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.94 -174.9 0.82 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.187 -0.46 . . . . 72.11 110.884 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.229 -0.441 . . . . 74.13 110.877 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 302' ' ' ' CA' . . . . . 0.641 'CA ' ' O ' ' A' ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' -2' ' ' LEU . . . . . 0.401 HD13 ' HA ' ' A' ' -2' ' ' LEU . 4.4 mm? . . . . . 0 C--O 1.231 0.115 0 CA-C-O 121.539 0.685 . . . . 73.02 110.915 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' -1' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.7 112.42 3.06 Favored 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.677 2.252 . . . . 71.15 112.345 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 0' ' ' LEU . . . . . 0.49 ' N ' ' HD2' ' A' ' 1' ' ' PRO . 2.3 mm? -68.67 -60.48 4.57 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.589 0.709 . . . . 62.13 110.877 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.49 ' HD2' ' N ' ' A' ' 0' ' ' LEU . 54.5 Cg_endo -69.71 170.29 16.86 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.696 2.264 . . . . 64.14 112.388 179.826 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -116.34 131.56 56.91 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.236 -0.438 . . . . 60.51 110.89 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -95.48 -15.24 23.06 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.234 -0.439 . . . . 74.01 110.9 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.29 -33.89 65.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.169 -0.469 . . . . 71.4 111.18 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -55.83 -42.75 86.55 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.734 -0.746 . . . . 60.51 112.517 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -109.07 21.51 26.98 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.778 -0.725 . . . . 54.22 112.47 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -78.38 153.71 31.36 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.783 0.325 . . . . 72.23 110.925 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.1 m -97.3 168.71 10.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.249 -0.432 . . . . 73.24 110.812 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -54.23 -31.93 54.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.118 -0.492 . . . . 50.12 110.927 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 7.0 tp -62.04 -40.62 96.37 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.166 -0.47 . . . . 72.33 110.963 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -61.73 -45.06 95.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.124 -0.489 . . . . 72.14 110.917 179.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.545 ' CH2' HD23 ' A' ' 54' ' ' LEU . 40.5 t-105 -73.17 -33.8 65.66 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.227 -0.442 . . . . 71.22 110.92 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -67.61 -35.47 79.02 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.274 -0.421 . . . . 72.51 110.93 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 16.9 mm-40 -65.73 -36.72 84.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.108 -0.496 . . . . 61.24 110.905 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.461 ' O ' ' HE3' ' A' ' 62' ' ' MET . . . -57.28 -38.91 74.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.234 -0.439 . . . . 54.34 111.059 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.62 ' NE2' HD13 ' A' ' 35' ' ' LEU . 0.4 OUTLIER -72.7 -42.98 63.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.212 -0.449 . . . . 73.12 110.867 -179.955 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.527 ' O ' ' HG3' ' A' ' 20' ' ' LYS . 2.9 m-20 -67.06 -31.49 72.04 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.258 -0.428 . . . . 72.4 110.86 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.478 ' HA ' ' HG2' ' A' ' 21' ' ' ARG . 3.2 m-85 -72.07 -43.07 65.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.153 -0.476 . . . . 75.11 110.914 -179.809 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.48 HD13 ' C ' ' A' ' 19' ' ' LEU . 3.1 tm? -73.61 -33.78 64.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.471 . . . . 72.51 110.879 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.527 ' HG3' ' O ' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -73.06 -35.84 66.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.183 -0.462 . . . . 74.41 110.927 179.769 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.478 ' HG2' ' HA ' ' A' ' 18' ' ' TYR . 0.6 OUTLIER -71.5 -27.96 63.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.208 -0.451 . . . . 74.05 110.869 -179.956 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -60.08 -25.28 65.28 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.193 -0.458 . . . . 74.31 110.833 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -120.78 50.49 1.34 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.203 -0.453 . . . . 72.55 110.899 -179.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.0 mt 69.47 -162.14 0.17 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.144 -0.48 . . . . 75.43 110.911 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -80.88 89.56 5.86 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.181 -0.463 . . . . 71.41 110.984 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 54.8 m-20 -97.41 90.28 5.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.086 -0.506 . . . . 74.25 110.84 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 13.7 m -85.2 -25.16 27.54 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.129 -0.487 . . . . 62.15 110.874 -179.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.9 -15.41 61.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.206 -0.452 . . . . 74.51 110.886 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.493 HG23 ' HD2' ' A' ' 38' ' ' LYS . 2.4 m -78.38 -2.96 40.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.164 -0.471 . . . . 70.44 111.157 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.37 169.44 0.05 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.196 -0.456 . . . . 73.33 110.886 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 65.84 147.52 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.243 -0.435 . . . . 64.43 110.855 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.96 -26.55 59.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.14 -0.482 . . . . 70.21 111.062 179.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -51.91 -44.98 64.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.274 -0.421 . . . . 35.31 110.887 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -85.52 -22.86 27.96 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.259 -0.428 . . . . 74.02 110.897 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.62 HD13 ' NE2' ' A' ' 16' ' ' GLN . 5.1 tp -58.83 -39.77 82.24 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.121 -0.491 . . . . 72.52 110.96 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.3 -51.38 63.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.197 -0.456 . . . . 73.13 110.899 179.865 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.34 -38.91 92.99 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.2 -0.454 . . . . 63.32 111.186 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.493 ' HD2' HG23 ' A' ' 29' ' ' THR . 2.3 mmtt -69.34 -42.11 75.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.226 -0.443 . . . . 72.32 110.836 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.565 HD21 HD22 ' A' ' 54' ' ' LEU . 1.7 mp -54.48 -38.71 66.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.317 -0.401 . . . . 72.11 110.922 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -58.69 -45.42 89.51 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.171 -0.468 . . . . 62.43 110.905 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.451 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 1.5 pt-20 -60.67 -32.85 72.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.27 -0.423 . . . . 75.11 110.89 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 9.0 ttt -68.52 -34.1 75.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.113 -0.494 . . . . 63.43 110.884 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.654 ' CD ' HD11 ' A' ' 48' ' ' LEU . 2.5 mm100 -59.95 -39.42 85.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.209 -0.45 . . . . 74.45 110.935 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.9 mmpt? -71.57 -30.6 66.04 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.163 -0.472 . . . . 71.43 110.895 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -70.46 -43.5 69.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.225 -0.443 . . . . 73.32 110.875 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.843 ' CZ ' HD13 ' A' ' 61' ' ' ILE . 6.6 m-85 -82.01 -34.95 29.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.127 -0.488 . . . . 70.43 110.852 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.404 ' HA2' ' HB3' ' A' ' 206' ' ' SER . . . 103.07 -6.97 51.78 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.733 -0.746 . . . . 64.34 112.455 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.654 HD11 ' CD ' ' A' ' 43' ' ' GLN . 0.6 OUTLIER -59.85 137.28 90.4 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-O 121.657 0.741 . . . . 64.11 110.911 -179.893 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.69 -52.23 0.34 Allowed 'Trans proline' 0 C--N 1.343 0.239 0 C-N-CA 122.675 2.25 . . . . 74.5 112.32 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.599 HD12 HG23 ' A' ' 58' ' ' VAL . 0.9 OUTLIER -50.96 108.29 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.206 -0.452 . . . . 71.22 111.186 179.95 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.419 ' HA ' ' HG3' ' A' ' 43' ' ' GLN . 3.6 p -99.21 152.48 19.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.18 -0.464 . . . . 73.25 111.197 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 59.2 17.73 39.23 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.761 -0.733 . . . . 64.24 112.472 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 15.2 mmt -102.8 161.04 14.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.828 0.347 . . . . 75.23 110.848 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.565 HD22 HD21 ' A' ' 39' ' ' LEU . 29.5 tp -168.54 81.94 0.16 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.186 -0.461 . . . . 73.4 110.854 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.405 ' HA ' HG13 ' A' ' 59' ' ' ILE . 0.3 OUTLIER 174.5 -28.09 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.227 -0.442 . . . . 44.35 110.936 179.877 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.8 p -87.85 -99.86 0.08 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.121 -0.49 . . . . 75.25 110.843 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.664 ' O ' HG23 ' A' ' 61' ' ' ILE . 17.4 tpt180 -84.97 -29.16 25.3 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.108 -0.496 . . . . 61.22 110.904 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.599 HG23 HD12 ' A' ' 50' ' ' ILE . 84.7 t -60.95 -45.04 99.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.225 -0.443 . . . . 70.12 111.126 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.432 HD13 ' HA ' ' A' ' 59' ' ' ILE . 7.6 mm -75.37 -31.66 24.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.202 -0.454 . . . . 74.43 111.111 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.6 -44.1 93.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.196 -0.457 . . . . 73.45 110.886 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.843 HD13 ' CZ ' ' A' ' 46' ' ' PHE . 1.5 pp -66.82 -29.47 46.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.165 -0.47 . . . . 74.52 111.184 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.461 ' HE3' ' O ' ' A' ' 15' ' ' ALA . 8.2 mmt -63.0 -38.67 92.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.161 -0.472 . . . . 74.01 110.844 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -84.49 -25.71 28.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.254 -0.43 . . . . 42.22 110.934 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.42 136.24 37.79 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.547 0.689 . . . . 65.34 110.924 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -69.82 156.84 62.16 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.731 2.287 . . . . 72.11 112.28 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.464 ' HG3' ' HA ' ' A' ' 214' ' ' PRO . 13.1 ttp180 -149.88 -83.89 0.1 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.181 -0.463 . . . . 71.51 110.89 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -145.58 153.9 41.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.181 -0.463 . . . . 55.3 110.893 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.554 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -108.02 24.58 22.83 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.745 -0.74 . . . . 64.23 112.457 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.625 HG21 ' CD2' ' A' ' 198' ' ' HIS . 0.2 OUTLIER -106.69 134.38 19.85 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 121.629 0.728 . . . . 74.23 111.065 -179.947 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.48 ' HD2' HG12 ' A' ' 69' ' ' VAL . 53.9 Cg_endo -69.75 143.32 50.53 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.717 2.278 . . . . 63.44 112.289 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -102.08 24.52 9.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.233 -0.44 . . . . 74.45 110.878 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 3.9 m -142.13 129.92 20.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.221 -0.445 . . . . 53.43 111.13 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -130.9 170.18 14.78 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.153 -0.476 . . . . 73.13 111.126 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 177.2 166.54 0.58 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.225 -0.443 . . . . 73.31 110.863 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER 59.94 170.21 0.08 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.11 -0.496 . . . . 70.41 110.931 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 10.6 m 64.39 155.41 0.07 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.122 -0.49 . . . . 74.2 110.904 -179.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -104.3 96.87 6.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.16 -0.473 . . . . 70.34 110.912 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 4.7 p90 -50.57 157.01 1.36 Allowed Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.649 0.738 . . . . 71.24 110.889 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.444 ' HG3' ' HA2' ' A' ' 163' ' ' GLY . 53.5 Cg_endo -69.88 -175.5 1.21 Allowed 'Trans proline' 0 C--N 1.341 0.147 0 C-N-CA 122.68 2.254 . . . . 73.34 112.328 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -51.21 103.35 0.06 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.243 -0.435 . . . . 74.43 110.892 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 62.65 160.25 0.12 Allowed Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.717 0.77 . . . . 70.4 110.877 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.71 -50.59 0.46 Allowed 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.694 2.262 . . . . 71.11 112.367 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.679 ' HD2' HD22 ' A' ' 237' ' ' LEU . 4.4 mttp -78.82 165.85 23.09 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.217 -0.447 . . . . 64.45 110.91 179.873 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . 0.414 ' CD1' ' HA ' ' A' ' 200' ' ' LEU . 52.6 m95 -49.71 137.72 15.49 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.235 -0.439 . . . . 73.31 110.864 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 2.2 t -115.28 -27.14 7.35 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.207 -0.451 . . . . 65.3 111.112 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -53.19 171.41 0.07 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.215 -0.448 . . . . 70.34 110.808 -179.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.58 -30.69 20.33 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.133 -0.485 . . . . 71.12 110.905 179.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.464 HG23 ' CD2' ' A' ' 123' ' ' HIS . 1.0 OUTLIER -148.39 140.43 18.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.214 -0.448 . . . . 74.14 111.108 179.888 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 90.4 t -123.35 141.39 43.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.155 -0.475 . . . . 72.25 111.106 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.758 HG22 ' HB3' ' A' ' 125' ' ' ARG . 15.2 p -115.61 155.16 28.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.188 -0.46 . . . . 71.01 111.202 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.437 ' O ' HG21 ' A' ' 127' ' ' VAL . 3.9 p90 -137.42 146.61 44.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.265 -0.425 . . . . 70.51 110.911 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.53 ' HB3' ' HB3' ' A' ' 132' ' ' ALA . 7.7 ttt-85 -150.87 139.09 20.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.123 -0.49 . . . . 71.25 110.9 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.543 HD11 ' HA ' ' A' ' 106' ' ' ASP . 10.3 mm -75.2 133.97 30.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.197 -0.456 . . . . 72.4 111.099 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.679 HG22 ' SD ' ' A' ' 135' ' ' MET . 8.1 t -91.32 -40.63 12.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.162 -0.472 . . . . 60.2 111.114 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -149.05 169.39 20.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.168 -0.469 . . . . 64.24 110.841 -179.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 14.8 p90 -132.29 155.01 49.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.161 -0.472 . . . . 72.25 110.925 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.5 t -102.38 141.78 34.66 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.169 -0.469 . . . . 64.11 111.101 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -52.5 -18.7 1.81 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.449 . . . . 72.14 110.863 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -65.08 -37.07 86.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.21 -0.45 . . . . 74.13 110.9 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.5 mp -142.47 152.11 59.46 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.65 0.738 . . . . 72.52 110.899 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . 0.572 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.9 Cg_endo -69.7 150.94 69.26 Favored 'Trans proline' 0 C--N 1.343 0.244 0 C-N-CA 122.637 2.225 . . . . 73.11 112.362 179.879 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -52.19 -27.84 16.1 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.19 -0.459 . . . . 74.11 110.828 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.572 HG22 ' HB2' ' A' ' 101' ' ' PRO . 2.2 tp -75.22 -38.91 42.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.212 -0.449 . . . . 74.02 111.173 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . 0.775 ' O ' HD22 ' A' ' 108' ' ' LEU . 2.9 m -69.34 -36.84 77.32 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.144 -0.48 . . . . 52.11 111.183 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.762 ' O ' HG13 ' A' ' 109' ' ' VAL . 55.2 t -71.43 -43.44 72.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.159 -0.473 . . . . 71.51 111.105 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.616 ' O ' HG22 ' A' ' 109' ' ' VAL . 24.9 t0 -66.54 -37.57 85.29 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.123 -0.489 . . . . 63.44 110.881 179.878 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . 0.488 ' HG3' ' N ' ' A' ' 108' ' ' LEU . 0.0 OUTLIER -70.36 -33.38 71.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.248 -0.433 . . . . 75.02 110.829 -179.865 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.775 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -66.11 -48.97 69.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.229 -0.441 . . . . 71.04 110.849 -179.891 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.762 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.4 m -55.13 -43.27 69.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.228 -0.442 . . . . 72.31 111.108 179.82 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.494 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 48.2 t -70.7 -34.33 71.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.149 -0.478 . . . . 72.14 110.867 -179.814 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.451 ' CG ' HD21 ' A' ' 189' ' ' LEU . 0.3 OUTLIER -62.56 -33.34 74.74 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.136 -0.483 . . . . 74.35 110.948 179.92 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -95.39 -40.49 9.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.254 -0.43 . . . . 74.32 111.108 179.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.719 ' CD1' HD12 ' A' ' 196' ' ' LEU . 0.4 OUTLIER -65.54 -32.76 74.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.197 -0.456 . . . . 72.0 110.939 -179.999 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 42.4 t30 -65.48 -35.29 80.46 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.187 -0.46 . . . . 72.34 110.84 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . 0.651 ' O ' HD11 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -68.31 -34.52 76.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.188 -0.46 . . . . 54.12 110.813 179.992 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' TRP . . . . . 0.412 ' CG ' HD11 ' A' ' 200' ' ' LEU . 6.0 m95 -66.99 -44.86 79.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.287 -0.415 . . . . 75.23 111.006 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -73.39 -40.74 47.56 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.73 -0.748 . . . . 73.32 112.45 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.431 ' HG2' ' O ' ' A' ' 115' ' ' MET . 3.8 ptpt -60.75 -18.43 54.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.811 0.338 . . . . 72.42 110.92 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.775 ' HG2' HD13 ' A' ' 226' ' ' LEU . 0.1 OUTLIER -96.87 13.46 28.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.167 -0.47 . . . . 75.24 110.884 179.934 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.917 HD12 HD12 ' A' ' 122' ' ' LEU . 3.6 pt -147.92 156.0 44.15 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.591 0.71 . . . . 71.34 111.15 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.77 0.27 5.9 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.675 2.25 . . . . 72.21 112.334 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.917 HD12 HD12 ' A' ' 120' ' ' ILE . 12.5 mt -61.18 -157.92 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.229 -0.441 . . . . 73.22 110.909 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.473 ' H ' ' HB3' ' A' ' 122' ' ' LEU . 4.5 t60 -162.66 137.92 6.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.159 -0.473 . . . . 74.12 110.907 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 17.5 m-30 -122.27 142.35 50.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.199 -0.455 . . . . 75.54 110.889 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.758 ' HB3' HG22 ' A' ' 90' ' ' THR . 0.0 OUTLIER -115.26 140.96 48.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.125 -0.489 . . . . 75.14 110.897 -179.888 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.19 141.62 34.02 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.196 -0.456 . . . . 72.22 110.886 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . 0.874 HG11 ' HB2' ' A' ' 132' ' ' ALA . 34.4 m -103.0 139.49 23.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.259 -0.428 . . . . 50.13 111.183 179.8 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -155.13 -29.25 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.165 -0.47 . . . . 74.43 111.077 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -133.22 109.19 9.25 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.146 -0.479 . . . . 71.25 110.881 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.46 -160.69 13.94 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.764 -0.732 . . . . 62.11 112.559 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -101.99 155.77 17.96 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.783 0.325 . . . . 63.25 111.16 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . 0.874 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -112.14 165.41 12.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.193 -0.458 . . . . 51.34 111.068 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -69.5 -54.67 13.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.204 -0.453 . . . . 75.41 110.931 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 27.8 mt -83.8 132.57 31.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.138 -0.483 . . . . 70.51 111.111 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . 0.679 ' SD ' HG22 ' A' ' 94' ' ' VAL . 28.3 mmt -108.81 116.93 32.93 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.158 -0.474 . . . . 72.43 110.932 179.829 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -106.13 88.39 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.251 -0.432 . . . . 70.04 111.124 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . 0.454 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -130.17 169.48 21.11 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.701 -0.762 . . . . 63.34 112.47 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' PHE . . . . . 0.491 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 36.5 m-85 -112.78 145.88 39.8 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.875 0.369 . . . . 74.01 110.874 -179.859 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.491 ' HB2' ' O ' ' A' ' 138' ' ' PHE . . . 173.72 166.44 0.18 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.156 -0.475 . . . . 71.21 111.135 179.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -104.8 172.96 6.51 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.259 -0.428 . . . . 62.21 110.847 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -54.02 -21.53 17.7 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.69 -0.766 . . . . 74.24 112.476 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -67.08 -12.07 58.9 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.812 0.339 . . . . 75.03 111.092 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 2.0 p80 -68.92 -11.6 60.79 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.252 -0.431 . . . . 71.11 110.855 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 117.68 36.57 0.97 Allowed Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.723 -0.751 . . . . 45.51 112.5 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -120.91 139.97 52.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.76 0.315 . . . . 72.14 110.937 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.23 161.76 18.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.451 . . . . 51.25 110.842 -179.7 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 11.9 m-85 64.71 133.52 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.649 0.738 . . . . 73.4 110.91 -179.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.79 134.81 28.82 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.621 2.214 . . . . 74.53 112.336 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -73.59 -33.1 64.45 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.207 -0.451 . . . . 63.52 110.851 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 74.57 -2.5 2.8 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.186 -0.461 . . . . 63.11 110.9 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . 0.676 ' O ' 'CA ' ' A' ' 302' ' ' ' CA' . . . 49.5 -108.72 0.49 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.706 -0.759 . . . . 71.41 112.531 -179.855 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.87 139.02 38.83 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.627 2.218 . . . . 75.11 112.325 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 103.21 -153.28 18.09 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.752 -0.737 . . . . 70.32 112.425 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -41.87 155.1 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.898 0.38 . . . . 73.25 110.894 -179.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 155' ' ' THR . . . . . 0.472 HG23 ' HA2' ' A' ' 68' ' ' GLY . 0.2 OUTLIER 75.31 108.78 0.07 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.132 -0.485 . . . . 44.41 111.158 -179.971 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . 1.053 HD21 HG21 ' A' ' 186' ' ' ILE . 0.5 OUTLIER -90.53 -53.67 4.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.177 -0.465 . . . . 75.02 110.866 -179.98 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . 0.587 ' HB1' ' O ' ' A' ' 171' ' ' HIS . . . -165.42 148.37 7.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.185 -0.461 . . . . 71.42 111.149 179.823 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 24.0 p-80 -106.13 126.53 52.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.245 -0.434 . . . . 72.02 110.84 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -110.91 160.9 16.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.155 -0.475 . . . . 74.42 111.061 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 13.6 m-85 -111.68 156.96 21.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.215 -0.448 . . . . 75.31 110.913 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . 0.69 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -87.79 164.09 35.62 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 121.586 0.708 . . . . 61.04 111.155 179.878 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 162' ' ' PRO . . . . . 0.69 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 54.5 Cg_endo -69.71 81.8 0.78 Allowed 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.755 2.304 . . . . 74.44 112.37 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 163' ' ' GLY . . . . . 0.444 ' HA2' ' HG3' ' A' ' 79' ' ' PRO . . . -146.7 128.8 3.11 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.727 -0.749 . . . . 61.41 112.448 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 63.9 -172.36 0.17 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.8 0.333 . . . . 73.1 111.174 -179.864 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -87.41 -41.51 6.49 Favored Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.736 -0.745 . . . . 74.03 112.409 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 166' ' ' LEU . . . . . 0.554 HD23 ' O ' ' A' ' 166' ' ' LEU . 8.8 tt -71.4 -32.78 68.82 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.84 0.352 . . . . 65.12 110.85 -179.811 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -79.35 172.45 55.11 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.665 -0.778 . . . . 43.43 112.467 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 78.03 23.08 67.13 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.679 -0.772 . . . . 74.31 112.479 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 95.2 m-20 -97.23 167.49 11.0 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.892 0.377 . . . . 63.41 110.837 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.91 130.34 56.15 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.151 -0.477 . . . . 74.21 111.096 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 171' ' ' HIS . . . . . 0.587 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 16.2 m170 -127.24 132.91 50.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.221 -0.445 . . . . 72.53 110.791 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 41.9 m-85 -116.86 139.59 50.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.171 -0.468 . . . . 71.44 110.904 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 65.4 t0 -69.38 97.18 0.95 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.151 -0.477 . . . . 74.11 110.861 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.97 -16.66 7.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.166 -0.47 . . . . 72.25 110.85 -179.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -79.48 -19.66 49.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.14 -0.482 . . . . 73.32 110.811 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -78.81 -174.87 4.17 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.237 -0.438 . . . . 63.2 110.932 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 177' ' ' ARG . . . . . 0.455 ' HG3' ' HA3' ' A' ' 185' ' ' GLY . 1.4 ptm180 -116.54 116.74 28.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.222 -0.444 . . . . 63.14 110.831 -179.874 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 178' ' ' TRP . . . . . 0.4 ' CE3' ' HB ' ' A' ' 186' ' ' ILE . 21.4 m95 -117.11 148.14 41.8 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.142 -0.481 . . . . 72.31 110.856 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 179' ' ' THR . . . . . 0.497 HG21 ' OG ' ' A' ' 182' ' ' SER . 7.5 t 179.16 163.65 0.87 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.206 -0.452 . . . . 74.13 111.167 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -128.35 -68.26 0.77 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.171 -0.468 . . . . 45.33 110.87 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -60.34 -15.16 37.14 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.672 -0.775 . . . . 62.41 112.536 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 182' ' ' SER . . . . . 0.497 ' OG ' HG21 ' A' ' 179' ' ' THR . 0.3 OUTLIER -97.51 -24.33 15.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.865 0.364 . . . . 64.5 110.862 -179.773 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 66.7 m 37.84 56.42 1.56 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.158 -0.474 . . . . 64.12 110.821 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 1.3 tp -116.9 -33.2 4.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.102 -0.499 . . . . 74.2 110.867 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 185' ' ' GLY . . . . . 0.455 ' HA3' ' HG3' ' A' ' 177' ' ' ARG . . . -114.37 -142.25 7.93 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.756 -0.735 . . . . 73.01 112.52 179.912 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 186' ' ' ILE . . . . . 1.053 HG21 HD21 ' A' ' 156' ' ' LEU . 11.1 mm -79.07 97.71 2.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.81 0.338 . . . . 73.22 111.125 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -45.53 117.21 1.36 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.199 -0.455 . . . . 71.31 110.815 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 188' ' ' PHE . . . . . 0.684 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.7 t80 -54.09 -36.91 63.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.106 -0.497 . . . . 75.45 110.868 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . 0.451 HD21 ' CG ' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -67.21 -47.33 71.2 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.135 -0.484 . . . . 52.02 110.886 -179.94 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -68.93 -41.43 78.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.177 -0.465 . . . . 74.22 110.953 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 191' ' ' ALA . . . . . 0.61 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -69.11 -35.19 76.16 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.138 -0.483 . . . . 50.03 111.062 179.873 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 192' ' ' ALA . . . . . 0.687 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -57.26 -44.05 83.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.225 -0.443 . . . . 52.11 111.034 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.08 -43.49 87.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.226 -0.443 . . . . 72.43 111.169 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 17.6 t-160 -73.12 -42.06 63.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.206 -0.452 . . . . 71.44 110.82 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -70.12 -47.53 61.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.206 -0.452 . . . . 71.01 111.114 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 196' ' ' LEU . . . . . 0.719 HD12 ' CD1' ' A' ' 113' ' ' LEU . 4.5 mm? -64.54 -37.94 89.3 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.192 -0.458 . . . . 74.51 110.901 -179.947 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -60.97 -27.29 66.82 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.757 -0.735 . . . . 52.23 112.501 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 198' ' ' HIS . . . . . 0.625 ' CD2' HG21 ' A' ' 69' ' ' VAL . 6.5 m-70 -67.98 -35.69 78.76 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.732 0.301 . . . . 75.21 110.799 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.96 -20.88 65.1 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.282 -0.417 . . . . 71.13 110.837 -179.764 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 200' ' ' LEU . . . . . 0.473 ' HB2' ' HG2' ' A' ' 202' ' ' MET . 0.5 OUTLIER -88.02 -0.04 56.53 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.175 -0.466 . . . . 64.13 110.926 -179.992 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 83.97 5.53 87.65 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.723 -0.751 . . . . 50.41 112.533 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 202' ' ' MET . . . . . 0.602 ' SD ' HD12 ' A' ' 234' ' ' ILE . 97.7 mmm -62.73 173.11 1.39 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.781 0.324 . . . . 63.21 110.907 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -137.16 169.19 24.08 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.779 -0.724 . . . . 64.44 112.535 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 20.5 m-70 -66.84 151.49 47.41 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.768 0.318 . . . . 74.32 110.857 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -118.99 146.06 45.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.222 -0.445 . . . . 53.34 110.835 -179.771 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 206' ' ' SER . . . . . 0.404 ' HB3' ' HA2' ' A' ' 47' ' ' GLY . 3.6 m -87.86 -4.19 58.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.104 -0.498 . . . . 72.22 110.899 -179.847 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 207' ' ' ASP . . . . . 0.419 ' O ' ' CD1' ' A' ' 213' ' ' TYR . 0.1 OUTLIER -71.33 142.87 87.36 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.571 0.701 . . . . 65.11 110.874 179.916 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.68 -29.96 23.43 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.658 2.238 . . . . 74.53 112.405 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 3.1 p-10 -105.57 25.36 10.85 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.214 -0.448 . . . . 63.52 110.845 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 210' ' ' ALA . . . . . 0.47 ' O ' ' HB2' ' A' ' 213' ' ' TYR . . . -87.31 146.3 25.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.22 -0.445 . . . . 62.23 111.096 179.814 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 211' ' ' VAL . . . . . 0.478 HG12 ' HG3' ' A' ' 212' ' ' MET . 0.4 OUTLIER -73.59 -26.61 22.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.187 -0.46 . . . . 62.04 111.145 179.974 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 212' ' ' MET . . . . . 0.478 ' HG3' HG12 ' A' ' 211' ' ' VAL . 0.0 OUTLIER -87.86 9.87 20.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.12 -0.491 . . . . 75.22 110.87 179.932 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 213' ' ' TYR . . . . . 0.47 ' HB2' ' O ' ' A' ' 210' ' ' ALA . 0.4 OUTLIER -54.93 120.16 27.01 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.676 0.751 . . . . 73.43 110.88 -179.851 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 214' ' ' PRO . . . . . 0.464 ' HA ' ' HG3' ' A' ' 66' ' ' ARG . 53.4 Cg_endo -69.75 -17.97 37.33 Favored 'Trans proline' 0 C--N 1.342 0.184 0 C-N-CA 122.604 2.203 . . . . 63.01 112.374 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -84.26 -2.4 56.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.18 -0.464 . . . . 74.24 111.2 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 1.5 t80 64.35 150.6 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.173 -0.467 . . . . 74.14 110.954 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -51.71 103.72 0.12 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.742 -0.742 . . . . 74.22 112.458 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -51.62 -59.42 4.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.876 0.37 . . . . 64.22 110.832 -179.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . -67.88 -175.07 8.5 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.742 -0.742 . . . . 72.24 112.491 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 220' ' ' ASP . . . . . . . . . . . . . 44.4 t0 -102.6 101.32 19.64 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.576 0.703 . . . . 41.43 110.833 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -69.72 114.36 3.67 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.683 2.255 . . . . 73.42 112.347 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -81.5 -38.6 26.04 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.237 -0.438 . . . . 74.21 110.937 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -121.81 -32.5 3.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.201 -0.454 . . . . 60.33 110.876 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER 65.65 135.36 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.155 -0.475 . . . . 65.01 110.915 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -143.8 160.55 40.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.455 . . . . 64.24 110.937 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . 0.775 HD13 ' HG2' ' A' ' 119' ' ' GLU . 6.6 mt -63.81 149.53 46.71 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.227 -0.442 . . . . 53.44 110.885 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 227' ' ' SER . . . . . . . . . . . . . 1.3 t -86.68 152.01 22.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.208 -0.451 . . . . 74.21 110.895 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 10.7 tt0 -64.4 -66.02 0.6 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.164 -0.471 . . . . 74.54 110.927 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 229' ' ' ASP . . . . . 0.439 ' O ' ' HG3' ' A' ' 232' ' ' LYS . 0.2 OUTLIER -56.08 -25.58 45.91 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.185 -0.462 . . . . 72.22 110.844 179.979 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 230' ' ' ASP . . . . . 0.401 ' OD2' HG12 ' A' ' 211' ' ' VAL . 0.5 OUTLIER -69.69 -48.7 58.74 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.205 -0.452 . . . . 74.23 110.855 -179.969 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 231' ' ' ILE . . . . . 0.67 HD11 ' HB3' ' A' ' 226' ' ' LEU . 9.2 mt -68.83 -41.58 82.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.152 -0.476 . . . . 73.41 111.12 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 232' ' ' LYS . . . . . 0.439 ' HG3' ' O ' ' A' ' 229' ' ' ASP . 0.0 OUTLIER -56.67 -32.06 65.03 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.167 -0.47 . . . . 65.42 110.89 179.855 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 233' ' ' GLY . . . . . 0.408 ' N ' ' HG3' ' A' ' 232' ' ' LYS . . . -64.95 -49.94 60.45 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.731 -0.747 . . . . 63.43 112.464 179.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 234' ' ' ILE . . . . . 0.602 HD12 ' SD ' ' A' ' 202' ' ' MET . 7.9 tt -72.84 -30.56 33.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.776 0.322 . . . . 71.54 111.173 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 13.0 mt-30 -69.72 -24.31 63.54 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.13 -0.486 . . . . 70.33 110.908 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 236' ' ' LYS . . . . . 0.449 ' HE2' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -73.81 -26.68 60.74 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.148 -0.478 . . . . 51.21 110.909 179.937 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 237' ' ' LEU . . . . . 0.679 HD22 ' HD2' ' A' ' 83' ' ' LYS . 10.3 tt -97.42 -36.17 10.44 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.223 -0.444 . . . . 75.41 110.931 179.911 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 238' ' ' TYR . . . . . 0.447 ' CE2' HD11 ' A' ' 122' ' ' LEU . 54.2 m-85 -92.12 -5.28 53.01 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.181 -0.463 . . . . 51.24 110.877 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -155.58 -117.04 0.56 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.778 -0.725 . . . . 32.22 112.435 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.03 149.59 31.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.709 0.29 . . . . 75.42 110.897 -179.917 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -89.47 -170.27 2.79 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.269 -0.423 . . . . 73.34 110.857 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 47.0 t -157.02 -41.89 0.07 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.227 -0.442 . . . . 62.42 110.902 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 15.0 p-10 -157.25 -174.21 4.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.124 -0.489 . . . . 72.13 110.95 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -92.55 160.72 14.91 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.241 -0.436 . . . . 62.23 110.871 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 7.4 ttp180 -163.87 142.25 7.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.15 -0.477 . . . . 70.43 110.872 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 1.7 tttt -87.62 149.13 24.49 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.189 -0.459 . . . . 72.11 110.85 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 4.8 tmtt? . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.228 -0.442 . . . . 74.13 110.838 179.863 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 302' ' ' ' CA' . . . . . 0.676 'CA ' ' O ' ' A' ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' -2' ' ' LEU . . . . . 0.54 ' H2 ' ' HD3' ' A' ' 57' ' ' ARG . 4.5 mm? . . . . . 0 C--O 1.231 0.129 0 CA-C-O 121.574 0.702 . . . . 73.02 110.878 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' -1' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.85 78.62 1.03 Allowed 'Trans proline' 0 C--O 1.231 0.157 0 C-N-CA 122.671 2.247 . . . . 71.15 112.315 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 0' ' ' LEU . . . . . 0.494 ' N ' ' HD2' ' A' ' 1' ' ' PRO . 2.6 mm? -68.85 -60.5 4.4 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.584 0.707 . . . . 62.13 110.913 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.494 ' HD2' ' N ' ' A' ' 0' ' ' LEU . 54.2 Cg_endo -69.71 -176.56 1.51 Allowed 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.665 2.243 . . . . 64.14 112.355 179.845 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -178.81 39.78 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.217 -0.447 . . . . 60.51 110.923 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -77.13 -7.26 55.47 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.15 -0.477 . . . . 74.01 110.902 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.484 ' HB1' ' OD1' ' A' ' 55' ' ' ASN . . . -56.48 -34.07 66.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.169 -0.469 . . . . 71.4 111.059 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -63.2 -22.59 65.33 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.734 -0.746 . . . . 60.51 112.49 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -108.46 21.6 28.16 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.714 -0.755 . . . . 54.22 112.559 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 26.3 mtm -82.02 164.2 21.59 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.765 0.317 . . . . 72.23 110.821 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.7 m -97.38 168.73 10.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.25 -0.432 . . . . 73.24 110.861 -179.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.25 -33.19 57.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.109 -0.496 . . . . 50.12 110.916 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.35 -42.79 78.7 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.149 -0.478 . . . . 72.33 110.942 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.66 -37.97 76.91 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.178 -0.465 . . . . 72.14 110.909 179.924 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 30.8 t-105 -72.44 -41.2 66.4 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.17 -0.468 . . . . 71.22 110.895 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -68.49 -35.2 77.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.292 -0.413 . . . . 72.51 110.911 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -62.92 -36.52 83.65 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.151 -0.477 . . . . 61.24 110.949 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.502 ' CB ' HD11 ' A' ' 59' ' ' ILE . . . -57.01 -42.95 81.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.169 -0.469 . . . . 54.34 111.075 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 11.1 tt0 -70.45 -42.98 70.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.259 -0.428 . . . . 73.12 110.911 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -65.8 -31.53 72.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.141 -0.482 . . . . 72.4 110.88 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -62.26 -36.1 80.99 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.185 -0.461 . . . . 75.11 110.873 -179.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.712 HD21 ' HG3' ' A' ' 42' ' ' MET . 4.0 mt -70.43 -21.07 62.86 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.127 -0.488 . . . . 72.51 110.935 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.411 ' HG2' ' N ' ' A' ' 21' ' ' ARG . 4.6 ptmt -74.59 -31.21 61.97 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.216 -0.447 . . . . 74.41 110.909 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.411 ' N ' ' HG2' ' A' ' 20' ' ' LYS . 4.4 ptp180 -86.65 -27.45 23.78 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.227 -0.442 . . . . 74.05 110.89 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.414 ' O ' ' HA ' ' A' ' 70' ' ' PRO . 1.7 m-85 -60.78 -13.06 12.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 74.31 110.835 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -120.45 -65.95 1.1 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.131 -0.486 . . . . 72.55 110.959 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.404 ' HG ' HG21 ' A' ' 72' ' ' VAL . 25.3 mt -157.48 -78.39 0.08 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.167 -0.469 . . . . 75.43 110.866 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -176.9 89.9 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.218 -0.447 . . . . 71.41 110.881 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -99.86 90.41 4.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.137 -0.483 . . . . 74.25 110.907 179.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.1 -35.07 22.03 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.21 -0.45 . . . . 62.15 110.825 -179.773 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -80.8 -21.39 40.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.202 -0.454 . . . . 74.51 110.892 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 59.9 m -76.88 -18.16 58.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.17 -0.468 . . . . 70.44 111.102 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 4.9 tttt -56.31 100.26 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.269 -0.423 . . . . 73.33 110.853 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -166.31 160.38 15.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.191 -0.458 . . . . 64.43 110.877 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.31 -35.45 63.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.118 -0.492 . . . . 70.21 111.15 179.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -78.19 -45.86 22.01 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.165 -0.47 . . . . 35.31 110.867 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.61 -27.83 68.02 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.195 -0.457 . . . . 74.02 110.83 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.581 ' CD2' HD22 ' A' ' 39' ' ' LEU . 1.3 tt -57.89 -37.94 74.91 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.134 -0.485 . . . . 72.52 110.887 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.72 -48.37 74.9 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.191 -0.458 . . . . 73.13 110.92 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.28 -48.52 76.45 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.128 -0.487 . . . . 63.32 111.136 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.499 ' HE3' HD13 ' A' ' 19' ' ' LEU . 0.5 OUTLIER -67.9 -38.64 83.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.234 -0.439 . . . . 72.32 110.856 179.978 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.599 HD21 ' HB2' ' A' ' 54' ' ' LEU . 1.1 mp -54.58 -36.59 64.56 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.242 -0.435 . . . . 72.11 110.859 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.35 -45.68 87.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.173 -0.467 . . . . 62.43 110.907 179.836 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -69.7 -34.81 74.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.211 -0.45 . . . . 75.11 110.917 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.712 ' HG3' HD21 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -68.51 -47.04 68.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.107 -0.497 . . . . 63.43 110.909 179.912 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.55 ' CG ' HD11 ' A' ' 48' ' ' LEU . 3.2 mt-30 -58.57 -44.24 89.7 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.246 -0.434 . . . . 74.45 110.869 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.5 mmpt? -68.26 -29.99 68.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.175 -0.466 . . . . 71.43 110.904 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 30.0 t80 -69.98 -35.39 74.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.182 -0.463 . . . . 73.32 110.903 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.495 ' CB ' HD23 ' A' ' 48' ' ' LEU . 5.3 m-85 -79.57 -29.77 41.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.162 -0.472 . . . . 70.43 110.825 -179.891 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.45 ' HA2' ' HB2' ' A' ' 206' ' ' SER . . . 104.74 -10.56 49.1 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.694 -0.765 . . . . 64.34 112.536 -179.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.55 HD11 ' CG ' ' A' ' 43' ' ' GLN . 0.8 OUTLIER -67.27 139.34 94.8 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.683 0.754 . . . . 64.11 110.865 -179.86 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.71 -52.69 0.31 Allowed 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.705 2.27 . . . . 74.5 112.351 179.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.446 ' O ' HD12 ' A' ' 48' ' ' LEU . 0.6 OUTLIER -49.24 108.1 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.212 -0.449 . . . . 71.22 111.133 179.939 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 1.5 t -107.01 163.68 12.77 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.198 -0.456 . . . . 73.25 111.131 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 60.82 17.02 49.06 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.747 -0.74 . . . . 64.24 112.465 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -114.13 161.13 18.16 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.852 0.358 . . . . 75.23 110.899 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.599 ' HB2' HD21 ' A' ' 39' ' ' LEU . 55.5 tp -173.29 85.1 0.05 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.23 -0.441 . . . . 73.4 110.929 -179.928 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.484 ' OD1' ' HB1' ' A' ' 4' ' ' ALA . 2.6 m-20 172.44 -27.1 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.241 -0.436 . . . . 44.35 110.917 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 2.5 p -88.8 -97.14 0.09 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.224 -0.444 . . . . 75.25 110.875 -179.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.54 ' HD3' ' H2 ' ' A' ' -2' ' ' LEU . 9.6 tpt180 -85.04 -32.38 22.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.146 -0.479 . . . . 61.22 110.89 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 69.1 t -60.14 -45.47 95.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.225 -0.443 . . . . 70.12 111.166 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.502 HD11 ' CB ' ' A' ' 15' ' ' ALA . 0.8 OUTLIER -69.73 -31.32 48.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.168 -0.469 . . . . 74.43 111.113 179.881 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -59.36 -34.15 72.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.227 -0.442 . . . . 73.45 110.917 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.641 HG21 HG22 ' A' ' 215' ' ' THR . 0.2 OUTLIER -78.52 -30.03 15.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.108 -0.496 . . . . 74.52 111.121 179.977 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 5.2 mtt -63.11 -38.23 90.36 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.117 -0.492 . . . . 74.01 110.908 179.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -82.27 -23.14 35.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.147 -0.479 . . . . 42.22 110.927 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 27.5 mttm -85.34 140.77 36.5 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.638 0.732 . . . . 65.34 110.837 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.82 157.69 59.41 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.632 2.221 . . . . 72.11 112.361 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.413 ' HG3' ' HA ' ' A' ' 214' ' ' PRO . 34.5 ttp180 -155.18 -82.24 0.07 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.255 -0.429 . . . . 71.51 110.825 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -145.14 156.26 43.78 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.229 -0.441 . . . . 55.3 110.847 -179.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.637 ' HA2' HG23 ' A' ' 155' ' ' THR . . . -101.31 17.55 55.43 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.814 -0.708 . . . . 64.23 112.571 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.807 HG12 ' HD2' ' A' ' 70' ' ' PRO . 0.0 OUTLIER -109.19 143.49 27.79 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 121.732 0.777 . . . . 74.23 111.101 -179.95 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.807 ' HD2' HG12 ' A' ' 69' ' ' VAL . 53.2 Cg_endo -69.82 163.76 37.1 Favored 'Trans proline' 0 C--N 1.342 0.237 0 C-N-CA 122.713 2.275 . . . . 63.44 112.274 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 54.6 m-20 -112.53 33.79 4.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.152 -0.476 . . . . 74.45 110.822 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.404 HG21 ' HG ' ' A' ' 24' ' ' LEU . 1.8 m -137.55 129.42 40.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.224 -0.443 . . . . 53.43 111.229 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -131.02 170.71 14.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.174 -0.466 . . . . 73.13 111.058 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -138.49 173.07 11.98 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.165 -0.47 . . . . 73.31 110.824 -179.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -48.12 158.36 0.25 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.127 -0.488 . . . . 70.41 110.964 -179.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -50.96 122.11 7.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.222 -0.445 . . . . 74.2 110.885 -179.823 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.405 ' C ' ' CG ' ' A' ' 78' ' ' PHE . 2.2 mt -91.32 -24.62 19.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 70.34 110.811 -179.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . 0.676 ' H ' ' HD2' ' A' ' 79' ' ' PRO . 0.2 OUTLIER -153.59 -59.37 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.665 0.745 . . . . 71.24 110.877 179.954 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.676 ' HD2' ' H ' ' A' ' 78' ' ' PHE . 53.2 Cg_endo -69.83 175.48 8.1 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.672 2.248 . . . . 73.34 112.325 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 23.6 m120 -109.83 138.71 45.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.215 -0.448 . . . . 74.43 110.847 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 64.91 149.44 0.11 Allowed Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.681 0.753 . . . . 70.4 110.83 -179.852 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.72 -5.73 16.88 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.715 2.276 . . . . 71.11 112.382 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.723 ' CG ' HD22 ' A' ' 237' ' ' LEU . 0.2 OUTLIER -119.8 -168.07 1.54 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.226 -0.443 . . . . 64.45 110.903 179.918 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 58.1 m95 -76.14 140.01 41.56 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.205 -0.452 . . . . 73.31 110.887 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 11.4 t -114.67 -23.64 9.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.224 -0.443 . . . . 65.3 111.147 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -55.05 150.29 10.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.25 -0.432 . . . . 70.34 110.84 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 35.9 mmtt -64.86 -29.81 70.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.105 -0.498 . . . . 71.12 110.898 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.552 HG23 ' CD2' ' A' ' 123' ' ' HIS . 0.4 OUTLIER -148.63 138.15 15.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 74.14 111.147 179.862 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 85.1 t -114.91 130.45 69.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.454 . . . . 72.25 111.118 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.682 HG22 ' HB3' ' A' ' 125' ' ' ARG . 28.6 p -115.91 168.09 10.37 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.155 -0.475 . . . . 71.01 111.125 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 4.2 p90 -146.48 146.78 30.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.163 -0.471 . . . . 70.51 110.888 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 4.4 ttt180 -149.0 138.11 21.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.113 -0.494 . . . . 71.25 110.884 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.409 HD11 ' HA ' ' A' ' 106' ' ' ASP . 10.3 mm -76.48 135.3 27.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.223 -0.444 . . . . 72.4 111.147 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.485 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 17.9 t -91.14 -40.36 12.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.184 -0.462 . . . . 60.2 111.143 179.819 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 25.9 p -142.22 169.49 17.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.127 -0.488 . . . . 64.24 110.855 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 5.2 p90 -115.14 150.74 35.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.124 -0.489 . . . . 72.25 110.889 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.545 ' OG1' HG21 ' A' ' 105' ' ' VAL . 0.2 OUTLIER -83.05 141.05 32.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.083 -0.508 . . . . 64.11 111.139 -179.996 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 3.7 mtt-85 -73.0 -8.28 55.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.215 -0.448 . . . . 72.14 110.908 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -96.53 -26.0 15.43 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.148 -0.478 . . . . 74.13 110.893 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.663 HD21 ' HA ' ' A' ' 179' ' ' THR . 0.8 OUTLIER -135.91 153.51 77.11 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.676 0.75 . . . . 72.52 110.882 -179.904 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . 0.608 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.5 Cg_endo -69.76 150.91 68.82 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.684 2.256 . . . . 73.11 112.309 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 6.4 t-160 -53.34 -25.55 15.62 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.102 -0.499 . . . . 74.11 110.852 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.608 HG22 ' HB2' ' A' ' 101' ' ' PRO . 13.2 tt -76.54 -38.37 31.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.239 -0.437 . . . . 74.02 111.13 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . 0.624 ' O ' HD22 ' A' ' 108' ' ' LEU . 2.9 m -69.14 -40.59 78.15 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.193 -0.458 . . . . 52.11 111.161 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.735 ' O ' HG13 ' A' ' 109' ' ' VAL . 55.9 t -72.92 -46.06 53.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 71.51 111.146 179.869 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.653 ' O ' HG22 ' A' ' 109' ' ' VAL . 60.5 t0 -61.5 -44.9 96.24 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.142 -0.481 . . . . 63.44 110.94 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -70.03 -33.41 71.95 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.161 -0.472 . . . . 75.02 110.87 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.624 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -60.26 -49.27 78.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.451 . . . . 71.04 110.926 -179.94 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.735 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.5 m -55.3 -42.05 64.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.206 -0.452 . . . . 72.31 111.18 179.79 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.469 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 43.2 t -70.22 -33.45 71.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.138 -0.483 . . . . 72.14 110.804 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.458 ' HB3' HD21 ' A' ' 189' ' ' LEU . 0.8 OUTLIER -61.46 -33.05 73.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.15 -0.477 . . . . 74.35 110.853 -179.984 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.75 -40.15 9.11 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.262 -0.426 . . . . 74.32 111.135 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.799 HD12 HD12 ' A' ' 196' ' ' LEU . 0.3 OUTLIER -63.98 -33.63 76.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.216 -0.447 . . . . 72.0 110.891 -179.965 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -65.6 -35.65 81.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.205 -0.452 . . . . 72.34 110.925 179.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . 0.725 ' HB3' HD23 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -66.3 -31.95 73.07 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.13 -0.487 . . . . 54.12 110.913 179.892 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' TRP . . . . . 0.538 ' CZ3' HD11 ' A' ' 226' ' ' LEU . 8.7 m95 -73.98 -45.22 51.45 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.27 -0.423 . . . . 75.23 110.861 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -66.05 -44.75 90.8 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.775 -0.726 . . . . 73.32 112.464 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.471 ' HG3' ' O ' ' A' ' 115' ' ' MET . 0.0 OUTLIER -61.97 -17.38 56.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.702 0.287 . . . . 72.42 110.865 -179.943 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.459 ' HG3' ' HG ' ' A' ' 226' ' ' LEU . 34.5 mm-40 -91.32 2.26 56.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.244 -0.435 . . . . 75.24 110.847 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 1.023 HD12 HD12 ' A' ' 122' ' ' LEU . 6.0 pt -139.29 150.61 64.9 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.659 0.743 . . . . 71.34 111.094 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 6.35 1.34 Allowed 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.699 2.266 . . . . 72.21 112.43 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 1.023 HD12 HD12 ' A' ' 120' ' ' ILE . 11.3 mt -60.96 -161.11 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.129 -0.487 . . . . 73.22 110.986 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.552 ' CD2' HG23 ' A' ' 88' ' ' VAL . 3.5 t60 -151.03 122.48 7.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.24 -0.436 . . . . 74.12 110.858 179.893 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 10.6 m-30 -109.51 148.41 31.25 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.173 -0.467 . . . . 75.54 110.899 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.682 ' HB3' HG22 ' A' ' 90' ' ' THR . 0.0 OUTLIER -133.14 141.9 48.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.117 -0.492 . . . . 75.14 110.848 -179.907 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.8 147.58 30.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.152 -0.476 . . . . 72.22 110.934 -179.977 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . 1.02 HG11 ' HB2' ' A' ' 132' ' ' ALA . 30.1 m -103.25 126.29 57.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.26 -0.427 . . . . 50.13 111.162 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.598 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -142.52 -9.89 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.205 -0.452 . . . . 74.43 111.154 179.947 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' TRP . . . . . 0.598 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -155.75 109.08 2.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.116 -0.493 . . . . 71.25 110.87 -179.972 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.15 -159.96 14.38 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.748 -0.739 . . . . 62.11 112.502 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.8 156.21 17.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.842 0.354 . . . . 63.25 111.116 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . 1.02 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -111.83 165.1 12.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.191 -0.459 . . . . 51.34 111.081 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -67.66 -55.8 11.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.231 -0.441 . . . . 75.41 110.885 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 31.6 mt -92.4 133.04 35.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.223 -0.444 . . . . 70.51 111.167 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . 0.485 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 14.7 mmm -111.23 124.48 52.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.226 -0.443 . . . . 72.43 110.875 179.821 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -107.06 91.22 1.7 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.147 -0.479 . . . . 70.04 111.107 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . 0.423 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -132.38 164.25 23.9 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.736 -0.745 . . . . 63.34 112.507 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' PHE . . . . . 0.469 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 46.2 m-85 -105.67 144.28 32.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.793 0.33 . . . . 74.01 110.86 -179.819 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.469 ' HB2' ' O ' ' A' ' 138' ' ' PHE . . . 175.15 167.03 0.3 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.143 -0.48 . . . . 71.21 111.033 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 20.8 mtm105 -104.36 173.62 6.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.192 -0.458 . . . . 62.21 110.88 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -56.06 -17.1 15.47 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.734 -0.746 . . . . 74.24 112.547 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -83.5 3.48 32.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.812 0.339 . . . . 75.03 111.118 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 7.2 p80 -69.85 -30.39 67.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.236 -0.438 . . . . 71.11 110.848 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 144.51 41.03 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.747 -0.74 . . . . 45.51 112.462 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 55.4 p-10 -146.64 162.22 38.91 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.839 0.352 . . . . 72.14 110.89 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 51.0 m -81.65 -179.9 7.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.151 -0.477 . . . . 51.25 110.888 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 64.65 123.68 0.02 OUTLIER Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.684 0.754 . . . . 73.4 110.937 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.83 146.19 58.98 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.717 2.278 . . . . 74.53 112.344 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 149' ' ' PHE . . . . . 0.411 ' CE1' ' HB2' ' A' ' 173' ' ' ASP . 0.1 OUTLIER -90.81 -33.19 15.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.21 -0.45 . . . . 63.52 110.882 -179.952 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 73.87 -1.76 2.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.111 -0.495 . . . . 63.11 110.847 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . 0.652 ' O ' 'CA ' ' A' ' 302' ' ' ' CA' . . . 51.88 -111.83 1.64 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.762 -0.732 . . . . 71.41 112.459 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.82 139.59 40.39 Favored 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.68 2.254 . . . . 75.11 112.333 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 103.14 -153.14 18.12 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.757 -0.735 . . . . 70.32 112.452 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 154' ' ' ASN . . . . . 0.415 ' O ' ' CB ' ' A' ' 155' ' ' THR . 4.6 p30 -40.81 152.04 0.05 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.913 0.387 . . . . 73.25 110.891 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 155' ' ' THR . . . . . 0.637 HG23 ' HA2' ' A' ' 68' ' ' GLY . 1.4 m 78.34 110.81 0.07 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.189 -0.46 . . . . 44.41 111.112 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . 1.053 HD21 HG21 ' A' ' 186' ' ' ILE . 0.7 OUTLIER -92.25 -52.57 4.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.223 -0.444 . . . . 75.02 110.892 179.959 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . 0.556 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -166.81 148.12 6.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.246 -0.434 . . . . 71.42 111.087 179.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 24.6 p-80 -106.46 125.58 51.17 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.254 -0.43 . . . . 72.02 110.888 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -111.0 154.82 23.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 74.42 111.079 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 18.1 m-85 -104.21 150.09 24.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.183 -0.462 . . . . 75.31 110.842 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . 0.652 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -77.67 162.64 67.47 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 121.573 0.701 . . . . 61.04 111.122 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 162' ' ' PRO . . . . . 0.652 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 54.5 Cg_endo -69.68 77.51 1.04 Allowed 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.658 2.239 . . . . 74.44 112.369 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 163' ' ' GLY . . . . . 0.408 ' HA2' ' HB3' ' A' ' 79' ' ' PRO . . . -132.56 124.71 3.94 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.736 -0.745 . . . . 61.41 112.441 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 9.6 p 50.95 -170.72 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.856 0.36 . . . . 73.1 111.172 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -76.1 -57.51 4.0 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.775 -0.726 . . . . 74.03 112.479 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 166' ' ' LEU . . . . . 0.473 HD23 ' O ' ' A' ' 166' ' ' LEU . 7.7 tt -54.37 -39.69 67.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.853 0.358 . . . . 65.12 110.927 -179.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -81.01 153.63 34.43 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.693 -0.765 . . . . 43.43 112.446 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 95.12 23.02 21.19 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.747 -0.739 . . . . 74.31 112.537 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 82.4 m-20 -92.14 173.29 7.9 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.825 0.345 . . . . 63.41 110.88 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -118.2 130.63 56.2 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.166 -0.47 . . . . 74.21 111.114 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 171' ' ' HIS . . . . . 0.547 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 16.8 m170 -128.66 132.58 48.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.207 -0.451 . . . . 72.53 110.924 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -116.35 140.16 49.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.253 -0.431 . . . . 71.44 110.902 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 173' ' ' ASP . . . . . 0.411 ' HB2' ' CE1' ' A' ' 149' ' ' PHE . 68.0 t0 -69.22 96.85 0.87 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.117 -0.492 . . . . 74.11 110.778 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 2.6 pp20? -56.42 -17.95 9.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.222 -0.445 . . . . 72.25 110.886 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -79.55 -20.46 47.04 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.117 -0.492 . . . . 73.32 110.944 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 30.0 mm-40 -77.88 -172.4 2.66 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.16 -0.473 . . . . 63.2 110.926 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 177' ' ' ARG . . . . . 0.404 ' HG3' ' HA3' ' A' ' 185' ' ' GLY . 20.2 ptt180 -115.03 115.28 26.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.172 -0.467 . . . . 63.14 110.841 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 53.6 m95 -116.95 142.9 46.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.155 -0.475 . . . . 72.31 110.898 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 179' ' ' THR . . . . . 0.663 ' HA ' HD21 ' A' ' 100' ' ' LEU . 12.2 t -178.16 163.61 1.71 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.252 -0.431 . . . . 74.13 111.156 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -125.28 -68.9 0.82 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.209 -0.45 . . . . 45.33 110.896 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -63.99 -12.99 51.35 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.762 -0.732 . . . . 62.41 112.515 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 182' ' ' SER . . . . . 0.507 ' HB3' HG21 ' A' ' 179' ' ' THR . 0.4 OUTLIER -93.34 -24.41 18.12 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.852 0.358 . . . . 64.5 110.81 -179.712 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 86.9 p 38.27 42.96 0.56 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.185 -0.461 . . . . 64.12 110.839 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 2.3 tt -106.92 -33.42 7.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.126 -0.488 . . . . 74.2 110.913 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 185' ' ' GLY . . . . . 0.404 ' HA3' ' HG3' ' A' ' 177' ' ' ARG . . . -113.11 -145.46 9.38 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.69 -0.767 . . . . 73.01 112.428 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 186' ' ' ILE . . . . . 1.053 HG21 HD21 ' A' ' 156' ' ' LEU . 10.6 mm -78.93 97.77 2.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.875 0.369 . . . . 73.22 111.11 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -44.23 115.21 0.8 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.178 -0.464 . . . . 71.31 110.85 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 188' ' ' PHE . . . . . 0.552 ' HD2' ' HB3' ' A' ' 108' ' ' LEU . 1.4 t80 -53.88 -33.64 57.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.199 -0.455 . . . . 75.45 110.912 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . 0.574 HD12 ' HE2' ' A' ' 224' ' ' PHE . 0.2 OUTLIER -67.07 -48.25 68.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.098 -0.501 . . . . 52.02 110.922 -179.997 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.23 -39.77 74.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.151 -0.477 . . . . 74.22 110.938 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 191' ' ' ALA . . . . . 0.553 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -69.87 -34.9 74.18 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.171 -0.468 . . . . 50.03 111.047 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 192' ' ' ALA . . . . . 0.693 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -56.38 -44.61 80.36 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.247 -0.433 . . . . 52.11 111.1 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.77 -43.62 90.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 72.43 111.182 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 15.7 t-160 -72.9 -38.0 67.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.218 -0.446 . . . . 71.44 110.872 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -74.63 -47.38 32.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.201 -0.454 . . . . 71.01 111.117 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 196' ' ' LEU . . . . . 0.799 HD12 HD12 ' A' ' 113' ' ' LEU . 4.6 mm? -63.08 -45.78 90.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.259 -0.428 . . . . 74.51 110.906 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -54.86 -29.47 50.67 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.731 -0.747 . . . . 52.23 112.506 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 198' ' ' HIS . . . . . 0.461 ' CD2' HG21 ' A' ' 69' ' ' VAL . 6.4 m-70 -66.6 -35.89 81.28 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.887 0.375 . . . . 75.21 110.889 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 13.0 t -68.05 -21.28 65.01 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.171 -0.468 . . . . 71.13 110.877 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -89.55 -7.45 54.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.141 -0.481 . . . . 64.13 110.881 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 89.73 9.58 66.12 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.715 -0.755 . . . . 50.41 112.459 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 202' ' ' MET . . . . . . . . . . . . . 18.1 tpp -72.85 135.08 45.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.797 0.332 . . . . 63.21 110.92 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -101.34 159.11 18.71 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.799 -0.715 . . . . 64.44 112.453 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 11.2 m170 -54.77 163.04 1.04 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.736 0.303 . . . . 74.32 110.895 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -124.39 153.93 41.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.255 -0.429 . . . . 53.34 110.912 -179.878 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 206' ' ' SER . . . . . 0.45 ' HB2' ' HA2' ' A' ' 47' ' ' GLY . 7.9 p -88.2 -4.68 58.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.09 -0.504 . . . . 72.22 110.87 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.55 137.51 83.39 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.535 0.683 . . . . 65.11 110.882 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.74 -7.38 20.9 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.628 2.218 . . . . 74.53 112.383 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -125.48 29.32 6.04 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.132 -0.485 . . . . 63.52 110.867 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 210' ' ' ALA . . . . . 0.478 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.24 145.38 26.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.183 -0.462 . . . . 62.23 111.14 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -73.47 -25.14 20.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.218 -0.446 . . . . 62.04 111.143 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 35.3 mmm -95.24 9.52 39.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.451 . . . . 75.22 110.826 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 213' ' ' TYR . . . . . 0.434 ' HB2' ' O ' ' A' ' 210' ' ' ALA . 0.2 OUTLIER -55.59 126.7 64.65 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-O 121.633 0.73 . . . . 73.43 110.926 -179.895 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 214' ' ' PRO . . . . . 0.427 ' HD2' ' CD1' ' A' ' 213' ' ' TYR . 54.1 Cg_endo -69.69 -18.54 37.3 Favored 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.69 2.26 . . . . 63.01 112.313 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 215' ' ' THR . . . . . 0.641 HG22 HG21 ' A' ' 61' ' ' ILE . 18.6 p -99.85 66.97 1.42 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.213 -0.449 . . . . 74.24 111.052 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -41.2 122.66 1.87 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.222 -0.445 . . . . 74.14 110.877 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -77.71 172.39 55.16 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.745 -0.74 . . . . 74.22 112.51 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 12.4 t-20 -105.45 -22.35 13.03 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.864 0.364 . . . . 64.22 110.929 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . -51.58 155.35 3.96 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.728 -0.748 . . . . 72.24 112.52 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 220' ' ' ASP . . . . . 0.414 ' HA ' ' HD2' ' A' ' 221' ' ' PRO . 1.1 p-10 -119.86 101.23 48.09 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 121.605 0.717 . . . . 41.43 110.976 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 221' ' ' PRO . . . . . 0.414 ' HD2' ' HA ' ' A' ' 220' ' ' ASP . 53.9 Cg_endo -69.74 168.69 20.8 Favored 'Trans proline' 0 C--O 1.231 0.148 0 C-N-CA 122.691 2.261 . . . . 73.42 112.352 -179.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -75.49 -45.69 36.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.24 -0.437 . . . . 74.21 110.884 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -130.84 -40.83 1.18 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.214 -0.448 . . . . 60.33 110.859 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 224' ' ' PHE . . . . . 0.574 ' HE2' HD12 ' A' ' 189' ' ' LEU . 0.0 OUTLIER 63.93 126.99 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.157 -0.474 . . . . 65.01 110.855 -179.985 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.7 -170.8 3.39 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.124 -0.489 . . . . 64.24 110.931 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . 0.725 HD23 ' HB3' ' A' ' 115' ' ' MET . 0.9 OUTLIER -59.18 148.93 29.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.258 -0.428 . . . . 53.44 110.922 179.885 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 227' ' ' SER . . . . . 0.478 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 1.9 t -86.73 156.31 20.0 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.14 -0.482 . . . . 74.21 110.889 -179.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.71 -63.5 1.24 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.178 -0.464 . . . . 74.54 110.948 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 49.3 t0 -55.66 -27.47 50.16 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.233 -0.44 . . . . 72.22 110.878 179.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.77 -48.24 59.98 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.196 -0.456 . . . . 74.23 110.841 -179.977 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 231' ' ' ILE . . . . . 0.528 HD11 ' HB3' ' A' ' 226' ' ' LEU . 12.8 mt -68.32 -43.82 84.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.237 -0.438 . . . . 73.41 111.203 179.924 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.71 -32.45 73.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.074 -0.512 . . . . 65.42 110.867 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -62.78 -49.8 69.59 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.795 -0.717 . . . . 63.43 112.513 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 234' ' ' ILE . . . . . 0.529 ' CD1' HG21 ' A' ' 120' ' ' ILE . 18.9 tt -73.13 -32.27 38.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-O 120.803 0.335 . . . . 71.54 111.161 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -67.15 -29.19 68.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.112 -0.495 . . . . 70.33 110.86 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 236' ' ' LYS . . . . . 0.45 ' HE3' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.49 -24.21 58.98 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.2 -0.455 . . . . 51.21 110.903 179.935 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 237' ' ' LEU . . . . . 0.723 HD22 ' CG ' ' A' ' 83' ' ' LYS . 1.7 tt -97.58 -29.48 13.42 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.241 -0.436 . . . . 75.41 110.949 179.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 238' ' ' TYR . . . . . 0.463 ' OH ' HD11 ' A' ' 122' ' ' LEU . 3.9 m-85 -91.91 -35.72 13.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.175 -0.466 . . . . 51.24 110.851 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -139.69 -119.4 1.65 Allowed Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.786 -0.721 . . . . 32.22 112.435 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 2.4 pttm -90.42 153.68 20.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.807 0.337 . . . . 75.42 110.872 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 9.8 ptt-85 -90.79 -172.35 3.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.213 -0.449 . . . . 73.34 110.849 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 4.1 t -151.85 -66.26 0.17 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.203 -0.453 . . . . 62.42 110.906 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 13.8 t30 -178.4 90.2 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.155 -0.475 . . . . 72.13 110.896 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 1.2 p -177.12 160.46 1.76 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.152 -0.476 . . . . 62.23 110.854 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 4.0 mmm-85 -118.05 107.99 14.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.098 -0.501 . . . . 70.43 110.871 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -52.93 147.88 8.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.191 -0.458 . . . . 72.11 110.833 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 2.7 mtmt . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.176 -0.465 . . . . 74.13 110.952 179.798 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 302' ' ' ' CA' . . . . . 0.652 'CA ' ' O ' ' A' ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' -2' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.232 0.153 0 CA-C-O 121.598 0.713 . . . . 73.02 110.925 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' -1' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.91 114.7 3.81 Favored 'Trans proline' 0 C--O 1.232 0.199 0 C-N-CA 122.662 2.241 . . . . 71.15 112.308 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 37.1 mt -142.47 71.06 21.34 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-O 121.631 0.729 . . . . 62.13 110.973 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.79 -48.37 0.73 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.71 2.273 . . . . 64.14 112.334 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -176.09 97.3 0.06 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.178 -0.464 . . . . 60.51 110.884 -179.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -95.44 -28.39 14.94 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.199 -0.455 . . . . 74.01 110.9 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.505 ' HB2' ' CB ' ' A' ' 55' ' ' ASN . . . -56.66 -34.1 67.01 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.13 -0.486 . . . . 71.4 111.122 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -55.97 -23.44 38.7 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.674 -0.774 . . . . 60.51 112.506 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -108.2 20.1 31.18 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.744 -0.741 . . . . 54.22 112.468 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 26.3 mmt -102.11 164.23 11.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.741 0.305 . . . . 72.23 110.906 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -113.61 168.8 9.46 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.23 -0.441 . . . . 73.24 110.862 -179.765 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 24.6 pt-20 -54.4 -31.99 56.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.161 -0.472 . . . . 50.12 110.876 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.64 -42.75 99.78 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.195 -0.457 . . . . 72.33 110.885 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -62.42 -42.97 99.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.188 -0.46 . . . . 72.14 110.864 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.447 ' CE2' HD23 ' A' ' 54' ' ' LEU . 15.8 t-105 -73.09 -33.22 65.48 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.201 -0.454 . . . . 71.22 110.926 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -73.17 -36.49 66.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.229 -0.442 . . . . 72.51 110.947 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -63.77 -36.78 85.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.106 -0.497 . . . . 61.24 110.922 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.657 ' HB1' ' HE3' ' A' ' 62' ' ' MET . . . -63.6 -37.33 86.91 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.139 -0.482 . . . . 54.34 111.124 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.672 ' CD ' HD12 ' A' ' 35' ' ' LEU . 0.1 OUTLIER -67.65 -43.02 81.27 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.238 -0.437 . . . . 73.12 110.861 -179.925 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -73.94 -32.42 63.49 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.201 -0.454 . . . . 72.4 110.891 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 3.5 m-30 -70.65 -36.28 73.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.134 -0.485 . . . . 75.11 110.906 -179.795 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.679 HD13 HD22 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -71.7 -21.02 61.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.118 -0.492 . . . . 72.51 110.9 179.919 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 5.2 ptmt -74.77 -32.99 62.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.248 -0.433 . . . . 74.41 110.899 179.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.23 -26.4 33.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.244 -0.435 . . . . 74.05 110.852 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -65.3 -7.64 14.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.217 -0.447 . . . . 74.31 110.934 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.43 ' O ' HG23 ' A' ' 72' ' ' VAL . 8.9 m-85 -113.85 -76.29 0.58 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.097 -0.501 . . . . 72.55 110.94 -179.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.693 ' HG ' HG23 ' A' ' 72' ' ' VAL . 21.2 mt -160.45 29.82 0.16 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.1 -0.5 . . . . 75.43 110.938 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 5.6 t80 50.15 88.94 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.454 . . . . 71.41 110.908 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -125.9 124.95 41.98 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.089 -0.505 . . . . 74.25 110.867 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -84.99 -6.37 59.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.208 -0.451 . . . . 62.15 110.909 -179.818 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -74.4 -11.02 60.13 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.182 -0.463 . . . . 74.51 110.915 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 4.7 m -76.57 -2.29 31.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.152 -0.476 . . . . 70.44 111.122 -179.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.58 170.31 0.05 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.212 -0.449 . . . . 73.33 110.888 179.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 31.2 t-20 67.61 148.05 0.05 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.271 -0.422 . . . . 64.43 110.872 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.94 -26.35 59.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.145 -0.479 . . . . 70.21 111.109 179.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -51.96 -45.72 64.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.188 -0.46 . . . . 35.31 110.884 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -85.78 -19.84 30.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.188 -0.46 . . . . 74.02 110.832 -179.81 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.672 HD12 ' CD ' ' A' ' 16' ' ' GLN . 5.9 tt -61.51 -44.72 96.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.145 -0.48 . . . . 72.52 110.87 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -61.38 -48.78 79.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.242 -0.435 . . . . 73.13 110.893 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.79 -51.2 60.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.148 -0.478 . . . . 63.32 111.079 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.473 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.5 OUTLIER -59.78 -49.68 76.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.239 -0.437 . . . . 72.32 110.867 179.976 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.679 HD22 HD13 ' A' ' 19' ' ' LEU . 0.1 OUTLIER -55.34 -37.51 67.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.267 -0.424 . . . . 72.11 110.952 179.884 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.51 -45.58 88.47 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.219 -0.446 . . . . 62.43 110.844 179.798 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.473 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 2.2 pt-20 -60.56 -32.7 71.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.288 -0.414 . . . . 75.11 110.902 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -68.35 -34.32 75.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.032 -0.531 . . . . 63.43 110.865 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.574 ' OE1' HD11 ' A' ' 48' ' ' LEU . 4.9 mm-40 -58.35 -39.64 80.08 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.275 -0.42 . . . . 74.45 110.895 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.4 mmpt? -66.42 -28.73 68.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.22 -0.445 . . . . 71.43 110.935 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -70.49 -40.92 73.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.19 -0.459 . . . . 73.32 110.932 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.473 ' CB ' HD23 ' A' ' 48' ' ' LEU . 14.8 m-85 -82.03 -35.53 28.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.126 -0.488 . . . . 70.43 110.881 -179.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.411 ' HA3' ' HB2' ' A' ' 206' ' ' SER . . . 101.99 -8.99 56.33 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.711 -0.756 . . . . 64.34 112.518 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.574 HD11 ' OE1' ' A' ' 43' ' ' GLN . 0.7 OUTLIER -59.97 139.92 90.52 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.622 0.725 . . . . 64.11 110.922 -179.89 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.511 ' O ' HG23 ' A' ' 51' ' ' THR . 54.0 Cg_endo -69.74 -52.49 0.32 Allowed 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.651 2.234 . . . . 74.5 112.353 179.84 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.543 HD12 HG23 ' A' ' 58' ' ' VAL . 0.8 OUTLIER -52.15 108.06 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.271 -0.422 . . . . 71.22 111.167 179.868 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.511 HG23 ' O ' ' A' ' 49' ' ' PRO . 66.2 p -105.34 156.35 18.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.206 -0.452 . . . . 73.25 111.173 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 58.67 18.21 37.44 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.795 -0.716 . . . . 64.24 112.473 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -113.17 161.1 17.54 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.767 0.318 . . . . 75.23 110.887 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.447 HD23 ' CE2' ' A' ' 12' ' ' TRP . 25.8 tp -164.78 93.98 0.66 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.223 -0.444 . . . . 73.4 110.936 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.505 ' CB ' ' HB2' ' A' ' 4' ' ' ALA . 0.4 OUTLIER 178.18 -30.91 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.157 -0.474 . . . . 44.35 110.855 179.972 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 29.7 t -89.65 -102.24 0.09 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.175 -0.466 . . . . 75.25 110.919 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 65.9 mtt-85 -84.81 -27.13 27.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.184 -0.462 . . . . 61.22 110.953 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.543 HG23 HD12 ' A' ' 50' ' ' ILE . 84.2 t -65.62 -40.77 88.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.09 -0.504 . . . . 70.12 111.125 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -76.85 -31.43 19.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.214 -0.448 . . . . 74.43 111.145 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -65.02 -44.99 87.33 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.164 -0.471 . . . . 73.45 110.836 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.573 ' CG2' HG23 ' A' ' 215' ' ' THR . 14.9 pt -59.76 -29.63 43.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.163 -0.472 . . . . 74.52 111.148 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.657 ' HE3' ' HB1' ' A' ' 15' ' ' ALA . 9.7 mmm -60.64 -39.19 87.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.17 -0.468 . . . . 74.01 110.821 179.857 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -93.81 -25.64 17.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.265 -0.425 . . . . 42.22 110.905 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.69 118.35 71.53 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.605 0.717 . . . . 65.34 110.868 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.76 126.29 13.14 Favored 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.683 2.255 . . . . 72.11 112.371 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -121.29 -74.99 0.6 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.169 -0.469 . . . . 71.51 110.862 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 2.8 p -140.72 148.2 40.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.149 -0.478 . . . . 55.3 110.855 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.787 ' CA ' HG23 ' A' ' 155' ' ' THR . . . -93.9 13.88 66.48 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.701 -0.761 . . . . 64.23 112.495 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.632 HG12 ' HD2' ' A' ' 70' ' ' PRO . 0.1 OUTLIER -101.75 137.49 19.57 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.67 0.748 . . . . 74.23 111.073 -179.995 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.632 ' HD2' HG12 ' A' ' 69' ' ' VAL . 53.3 Cg_endo -69.83 159.12 54.53 Favored 'Trans proline' 0 C--O 1.231 0.153 0 C-N-CA 122.677 2.251 . . . . 63.44 112.33 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -94.53 4.91 53.24 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.198 -0.456 . . . . 74.45 110.813 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.693 HG23 ' HG ' ' A' ' 24' ' ' LEU . 0.1 OUTLIER -140.83 129.82 25.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.272 -0.422 . . . . 53.43 111.126 -179.983 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -130.98 170.42 14.5 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.122 -0.49 . . . . 73.13 111.138 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -158.03 120.07 3.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.27 -0.423 . . . . 73.31 110.861 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -170.42 94.38 0.22 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.113 -0.494 . . . . 70.41 110.933 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -55.95 177.21 0.06 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.173 -0.467 . . . . 74.2 110.8 -179.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 51.32 33.44 9.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.125 -0.489 . . . . 70.34 110.912 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 33.1 p90 -51.55 153.22 4.07 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.665 0.745 . . . . 71.24 110.85 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.407 ' HG3' ' HA2' ' A' ' 163' ' ' GLY . 53.2 Cg_endo -69.78 -175.13 1.06 Allowed 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.689 2.259 . . . . 73.34 112.343 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.545 ' HB2' HG21 ' A' ' 85' ' ' THR . 65.3 m-20 -64.27 97.43 0.19 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 74.43 110.851 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 63.57 157.51 0.12 Allowed Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.713 0.768 . . . . 70.4 110.781 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.75 -49.45 0.56 Allowed 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.702 2.268 . . . . 71.11 112.316 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.695 ' CE ' HD13 ' A' ' 237' ' ' LEU . 5.1 mttp -74.05 164.98 25.94 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.257 -0.428 . . . . 64.45 110.914 179.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . 0.499 ' CD1' ' HA ' ' A' ' 200' ' ' LEU . 19.6 m95 -52.86 132.5 37.05 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.248 -0.433 . . . . 73.31 110.87 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.545 HG21 ' HB2' ' A' ' 80' ' ' ASN . 5.6 t -115.08 -15.0 11.77 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.19 -0.459 . . . . 65.3 111.084 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -62.48 165.0 6.65 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.302 -0.408 . . . . 70.34 110.893 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.22 -30.26 38.59 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.165 -0.47 . . . . 71.12 110.909 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.507 HG23 ' CD2' ' A' ' 123' ' ' HIS . 1.1 p -148.12 137.84 16.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.214 -0.448 . . . . 74.14 111.174 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 97.2 t -119.1 138.66 49.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.158 -0.474 . . . . 72.25 111.141 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.684 HG22 ' HB3' ' A' ' 125' ' ' ARG . 7.5 p -115.87 168.07 10.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.157 -0.474 . . . . 71.01 111.088 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 6.5 p90 -147.08 147.08 30.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.15 -0.477 . . . . 70.51 110.979 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -146.85 136.39 22.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.136 -0.484 . . . . 71.25 110.847 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.639 ' CD1' HG11 ' A' ' 109' ' ' VAL . 16.4 mm -76.05 135.26 27.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.121 -0.49 . . . . 72.4 111.144 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.504 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 21.2 t -88.15 -40.68 13.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.191 -0.459 . . . . 60.2 111.128 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 4.3 t -153.74 158.88 41.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.178 -0.465 . . . . 64.24 110.951 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 10.5 p90 -106.1 147.71 28.64 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.248 -0.433 . . . . 72.25 110.902 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.539 ' O ' ' O ' ' A' ' 100' ' ' LEU . 0.3 OUTLIER -81.71 140.76 34.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.137 -0.483 . . . . 64.11 111.183 179.961 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -62.18 -15.98 49.95 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.244 -0.434 . . . . 72.14 110.834 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -91.16 -25.33 19.62 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.225 -0.443 . . . . 74.13 110.902 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.745 HD21 ' H ' ' A' ' 180' ' ' ASP . 18.4 mt -131.69 140.02 37.02 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.515 0.674 . . . . 72.52 110.928 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . 0.604 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.3 Cg_endo -69.8 150.87 68.53 Favored 'Trans proline' 0 C--O 1.232 0.218 0 C-N-CA 122.653 2.235 . . . . 73.11 112.309 179.872 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 3.1 t-160 -49.27 -29.99 6.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.226 -0.443 . . . . 74.11 110.823 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.604 HG22 ' HB2' ' A' ' 101' ' ' PRO . 16.6 tt -72.7 -43.16 61.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.214 -0.448 . . . . 74.02 111.136 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . 0.599 HG21 HD22 ' A' ' 100' ' ' LEU . 2.3 m -69.63 -38.13 77.06 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.132 -0.485 . . . . 52.11 111.118 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.755 HG13 ' CZ ' ' A' ' 188' ' ' PHE . 75.5 t -72.87 -44.61 57.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.226 -0.443 . . . . 71.51 111.096 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.666 ' O ' HG22 ' A' ' 109' ' ' VAL . 29.7 t70 -62.95 -43.22 99.39 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.216 -0.447 . . . . 63.44 110.87 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -70.13 -33.25 71.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.205 -0.452 . . . . 75.02 110.846 -179.839 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.586 HD23 ' HB3' ' A' ' 188' ' ' PHE . 0.0 OUTLIER -60.18 -47.59 85.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.164 -0.471 . . . . 71.04 110.9 -179.957 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.666 HG22 ' O ' ' A' ' 106' ' ' ASP . 1.4 m -55.2 -41.46 60.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.161 -0.472 . . . . 72.31 111.171 179.843 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.477 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 42.5 t -70.56 -33.64 71.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.169 -0.469 . . . . 72.14 110.858 -179.857 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.589 ' HB3' HD21 ' A' ' 189' ' ' LEU . 0.5 OUTLIER -61.59 -33.1 73.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.099 -0.5 . . . . 74.35 110.879 179.943 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.56 -40.28 9.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.193 -0.458 . . . . 74.32 111.066 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.835 HD12 HD12 ' A' ' 196' ' ' LEU . 0.3 OUTLIER -65.59 -33.62 76.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.181 -0.463 . . . . 72.0 110.913 -179.95 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 44.2 t30 -69.64 -38.23 77.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.181 -0.463 . . . . 72.34 110.899 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . 0.573 ' HB3' HD23 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -60.42 -34.23 73.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.138 -0.483 . . . . 54.12 110.865 179.897 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' TRP . . . . . 0.452 ' CZ3' HD11 ' A' ' 226' ' ' LEU . 14.5 m95 -70.23 -50.09 43.42 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.243 -0.435 . . . . 75.23 110.928 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . 0.433 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -66.34 -36.42 91.63 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.781 -0.724 . . . . 73.32 112.529 179.872 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 43.2 mtmt -61.66 -16.52 49.45 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.706 0.289 . . . . 72.42 110.838 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.704 ' HB3' HG23 ' A' ' 231' ' ' ILE . 71.3 mm-40 -101.32 13.42 35.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.276 -0.42 . . . . 75.24 110.875 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 1.021 HD12 HD12 ' A' ' 122' ' ' LEU . 5.3 pt -148.26 152.18 38.69 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.656 0.741 . . . . 71.34 111.134 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.66 4.7 1.99 Allowed 'Trans proline' 0 C--O 1.232 0.212 0 C-N-CA 122.718 2.279 . . . . 72.21 112.387 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 1.021 HD12 HD12 ' A' ' 120' ' ' ILE . 10.2 mt -60.72 -158.34 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.243 -0.435 . . . . 73.22 110.936 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.507 ' CD2' HG23 ' A' ' 88' ' ' VAL . 4.3 t60 -161.7 140.69 9.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.144 -0.48 . . . . 74.12 110.809 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . 0.411 ' CD2' HD21 ' A' ' 113' ' ' LEU . 37.9 m-85 -125.0 148.41 48.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.192 -0.458 . . . . 75.54 110.875 -179.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.684 ' HB3' HG22 ' A' ' 90' ' ' THR . 0.0 OUTLIER -124.38 141.09 52.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.154 -0.476 . . . . 75.14 110.854 -179.896 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.98 139.87 35.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.217 -0.447 . . . . 72.22 110.927 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . 0.939 HG11 ' HB2' ' A' ' 132' ' ' ALA . 17.3 m -102.81 131.97 49.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.151 -0.477 . . . . 50.13 111.15 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.451 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -144.41 -23.14 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.219 -0.446 . . . . 74.43 111.132 179.894 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' TRP . . . . . 0.451 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -138.77 109.1 6.47 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.188 -0.46 . . . . 71.25 110.896 -179.997 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 108.18 -159.84 14.12 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.714 -0.755 . . . . 62.11 112.501 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -101.89 155.66 18.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.792 0.33 . . . . 63.25 111.15 -179.877 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . 0.939 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -112.22 165.24 12.34 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.181 -0.463 . . . . 51.34 111.088 179.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -67.44 -62.8 1.24 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.181 -0.463 . . . . 75.41 110.895 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . 0.441 HG23 ' HA ' ' A' ' 169' ' ' ASP . 45.5 mt -87.67 139.8 16.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.227 -0.442 . . . . 70.51 111.163 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . 0.504 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 16.4 mmm -114.33 130.19 56.66 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.2 -0.455 . . . . 72.43 110.904 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.426 HG21 ' CG1' ' A' ' 109' ' ' VAL . 0.3 OUTLIER -111.17 88.15 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.3 -0.409 . . . . 70.04 111.119 179.969 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . 0.415 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -134.11 157.27 22.78 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.673 -0.775 . . . . 63.34 112.389 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' PHE . . . . . 0.579 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 31.2 p90 -105.43 151.62 24.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.886 0.374 . . . . 74.01 110.871 -179.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.579 ' HB2' ' O ' ' A' ' 138' ' ' PHE . . . 169.64 168.81 0.05 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.197 -0.456 . . . . 71.21 111.089 179.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 18.1 mtp180 -102.64 172.87 6.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.18 -0.463 . . . . 62.21 110.849 -179.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -54.03 -17.43 7.43 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.707 -0.759 . . . . 74.24 112.54 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -85.58 13.09 7.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.865 0.364 . . . . 75.03 111.188 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 5.1 p80 -85.91 1.91 48.12 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.21 -0.45 . . . . 71.11 110.864 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 106.07 38.47 2.31 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.764 -0.732 . . . . 45.51 112.465 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -139.71 176.47 8.71 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.844 0.354 . . . . 72.14 110.882 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 66.9 m -85.7 166.76 15.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.222 -0.445 . . . . 51.25 110.844 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 66.23 127.73 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.69 0.757 . . . . 73.4 110.89 -179.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.74 152.41 69.41 Favored 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.709 2.273 . . . . 74.53 112.408 179.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 149' ' ' PHE . . . . . 0.43 ' C ' ' H ' ' A' ' 151' ' ' GLY . 1.5 p90 -52.65 -25.58 11.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.26 -0.427 . . . . 63.52 110.887 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 75.97 -20.87 0.33 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.179 -0.464 . . . . 63.11 110.875 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . 0.43 ' H ' ' C ' ' A' ' 149' ' ' PHE . . . 81.44 -161.29 42.69 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.73 -0.748 . . . . 71.41 112.417 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.68 141.88 46.76 Favored 'Trans proline' 0 C--N 1.343 0.243 0 C-N-CA 122.683 2.255 . . . . 75.11 112.403 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 103.71 -133.29 11.4 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.746 -0.74 . . . . 70.32 112.497 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -37.34 148.31 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.943 0.401 . . . . 73.25 110.855 -179.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 155' ' ' THR . . . . . 0.787 HG23 ' CA ' ' A' ' 68' ' ' GLY . 59.6 m 65.72 115.11 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.142 -0.481 . . . . 44.41 111.108 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . 1.032 HD21 HG21 ' A' ' 186' ' ' ILE . 1.0 OUTLIER -103.9 -52.72 2.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.179 -0.464 . . . . 75.02 110.897 179.975 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . 0.564 ' HB1' ' O ' ' A' ' 171' ' ' HIS . . . -153.76 148.27 26.16 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.235 -0.438 . . . . 71.42 111.073 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 26.3 p-80 -111.01 117.49 33.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.21 -0.45 . . . . 72.02 110.831 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -109.81 148.3 31.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.221 -0.445 . . . . 74.42 111.071 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 -104.06 169.5 8.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.172 -0.467 . . . . 75.31 110.836 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . 0.612 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -104.42 161.47 22.77 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.575 0.703 . . . . 61.04 111.161 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 162' ' ' PRO . . . . . 0.612 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.9 Cg_endo -69.68 88.11 0.53 Allowed 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.724 2.283 . . . . 74.44 112.348 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 163' ' ' GLY . . . . . 0.407 ' HA2' ' HG3' ' A' ' 79' ' ' PRO . . . -146.43 136.78 6.44 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.767 -0.73 . . . . 61.41 112.463 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 2.7 m 72.24 -69.2 0.19 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.82 0.343 . . . . 73.1 111.122 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . 160.44 -59.49 0.31 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.76 -0.733 . . . . 74.03 112.527 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 166' ' ' LEU . . . . . 0.414 ' C ' HD23 ' A' ' 166' ' ' LEU . 10.3 tt -54.07 -35.13 61.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.865 0.364 . . . . 65.12 110.944 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -74.28 -163.75 10.07 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.726 -0.75 . . . . 43.43 112.494 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 73.13 11.9 79.32 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.676 -0.773 . . . . 74.31 112.435 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 169' ' ' ASP . . . . . 0.441 ' HA ' HG23 ' A' ' 134' ' ' ILE . 61.7 m-20 -91.51 171.38 9.23 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.829 0.347 . . . . 63.41 110.855 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -117.5 131.58 56.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.211 -0.45 . . . . 74.21 111.082 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 171' ' ' HIS . . . . . 0.564 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 28.7 m170 -124.72 158.86 32.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.21 -0.45 . . . . 72.53 110.854 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 172' ' ' PHE . . . . . 0.438 ' HB3' ' CZ2' ' A' ' 178' ' ' TRP . 25.0 m-85 -134.03 143.99 48.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.183 -0.462 . . . . 71.44 110.896 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 173' ' ' ASP . . . . . 0.438 ' CB ' ' O ' ' A' ' 156' ' ' LEU . 49.1 t0 -71.07 103.28 2.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.109 -0.496 . . . . 74.11 110.829 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 174' ' ' GLU . . . . . 0.454 ' HB2' ' C ' ' A' ' 139' ' ' ALA . 0.5 OUTLIER -58.27 -16.92 15.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.158 -0.474 . . . . 72.25 110.907 -179.939 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -77.85 -15.16 59.26 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.148 -0.478 . . . . 73.32 110.851 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -89.73 176.78 6.72 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.202 -0.454 . . . . 63.2 110.878 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 77.8 mtt180 -103.02 123.05 45.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.143 -0.481 . . . . 63.14 110.882 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 178' ' ' TRP . . . . . 0.488 ' HB2' HG21 ' A' ' 97' ' ' THR . 44.4 m95 -117.48 132.38 56.56 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.217 -0.447 . . . . 72.31 110.904 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 179' ' ' THR . . . . . 0.597 HG21 ' HB3' ' A' ' 182' ' ' SER . 3.5 t -177.46 164.13 2.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.235 -0.439 . . . . 74.13 111.15 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . 0.745 ' H ' HD21 ' A' ' 100' ' ' LEU . 3.9 t70 -124.03 -68.77 0.85 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.211 -0.45 . . . . 45.33 110.818 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -66.15 -10.87 53.8 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.772 -0.728 . . . . 62.41 112.548 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 182' ' ' SER . . . . . 0.597 ' HB3' HG21 ' A' ' 179' ' ' THR . 0.2 OUTLIER -97.65 -24.34 15.56 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.887 0.375 . . . . 64.5 110.854 -179.766 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 183' ' ' SER . . . . . 0.435 ' C ' ' O ' ' A' ' 182' ' ' SER . 1.8 p 34.55 65.43 0.34 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.133 -0.485 . . . . 64.12 110.815 -179.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -117.1 -33.76 4.6 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.157 -0.474 . . . . 74.2 110.895 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -124.54 -136.33 4.6 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.797 -0.716 . . . . 73.01 112.508 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 186' ' ' ILE . . . . . 1.032 HG21 HD21 ' A' ' 156' ' ' LEU . 7.3 mm -79.21 105.88 9.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-O 120.872 0.368 . . . . 73.22 111.092 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -51.07 123.9 10.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.138 -0.483 . . . . 71.31 110.838 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 188' ' ' PHE . . . . . 0.755 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 4.3 t80 -53.6 -35.52 60.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.171 -0.468 . . . . 75.45 110.896 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . 0.589 HD21 ' HB3' ' A' ' 111' ' ' LYS . 0.1 OUTLIER -67.46 -47.38 70.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.113 -0.494 . . . . 52.02 110.915 -179.892 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -66.06 -37.55 86.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.159 -0.473 . . . . 74.22 110.948 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -72.54 -35.34 68.02 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.109 -0.496 . . . . 50.03 111.095 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 192' ' ' ALA . . . . . 0.705 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -60.8 -44.62 96.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.235 -0.439 . . . . 52.11 111.04 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -58.1 -44.47 87.69 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.219 -0.446 . . . . 72.43 111.162 -179.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 2.8 t60 -72.58 -42.76 64.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.138 -0.483 . . . . 71.44 110.842 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -68.84 -47.23 66.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.233 -0.44 . . . . 71.01 111.114 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 196' ' ' LEU . . . . . 0.835 HD12 HD12 ' A' ' 113' ' ' LEU . 4.5 mm? -63.13 -43.61 97.91 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.239 -0.437 . . . . 74.51 110.912 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -56.2 -29.29 56.02 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.707 -0.758 . . . . 52.23 112.522 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 198' ' ' HIS . . . . . 0.481 ' CD2' HG21 ' A' ' 69' ' ' VAL . 5.9 m-70 -68.03 -40.32 82.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.864 0.364 . . . . 75.21 110.899 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.85 -21.17 62.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.17 -0.468 . . . . 71.13 110.828 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 200' ' ' LEU . . . . . 0.499 ' HA ' ' CD1' ' A' ' 84' ' ' TRP . 0.6 OUTLIER -90.44 2.75 55.35 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.147 -0.479 . . . . 64.13 110.915 179.992 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 83.71 -4.03 83.5 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.729 -0.748 . . . . 50.41 112.483 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 202' ' ' MET . . . . . 0.496 ' SD ' HD12 ' A' ' 234' ' ' ILE . 97.9 mmm -63.85 133.46 53.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.789 0.328 . . . . 63.21 110.877 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -101.48 -176.34 28.6 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.781 -0.724 . . . . 64.44 112.526 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 20.7 m-70 -73.84 144.34 45.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.798 0.332 . . . . 74.32 110.893 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -103.93 153.46 20.77 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.249 -0.432 . . . . 53.34 110.838 -179.776 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 206' ' ' SER . . . . . 0.411 ' HB2' ' HA3' ' A' ' 47' ' ' GLY . 6.5 p -87.79 -4.78 58.86 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.486 . . . . 72.22 110.814 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.55 137.82 83.4 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.619 0.723 . . . . 65.11 110.881 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 -6.62 19.01 Favored 'Trans proline' 0 C--N 1.342 0.222 0 C-N-CA 122.682 2.254 . . . . 74.53 112.336 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -127.92 30.16 5.31 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.189 -0.46 . . . . 63.52 110.886 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 210' ' ' ALA . . . . . 0.48 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.22 145.51 26.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.194 -0.457 . . . . 62.23 111.132 179.851 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 211' ' ' VAL . . . . . 0.409 HG12 ' OD2' ' A' ' 230' ' ' ASP . 0.4 OUTLIER -68.35 -27.52 37.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.238 -0.437 . . . . 62.04 111.145 179.954 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -98.25 10.53 40.41 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.209 -0.451 . . . . 75.22 110.846 179.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 213' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -55.71 118.08 18.19 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.698 0.761 . . . . 73.43 110.909 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.82 -18.47 36.71 Favored 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 122.611 2.207 . . . . 63.01 112.363 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 215' ' ' THR . . . . . 0.573 HG23 ' CG2' ' A' ' 61' ' ' ILE . 0.3 OUTLIER -84.79 49.97 1.82 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.174 -0.466 . . . . 74.24 111.172 179.988 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -57.02 124.22 17.93 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.202 -0.454 . . . . 74.14 110.925 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . 128.8 67.15 0.12 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.753 -0.736 . . . . 74.22 112.512 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -130.0 -74.78 0.54 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.901 0.381 . . . . 64.22 110.907 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . -136.08 171.76 22.65 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.766 -0.731 . . . . 72.24 112.536 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 220' ' ' ASP . . . . . 0.405 ' HA ' ' HD2' ' A' ' 221' ' ' PRO . 0.3 OUTLIER -120.31 101.52 46.66 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 121.625 0.726 . . . . 41.43 110.833 -179.954 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 221' ' ' PRO . . . . . 0.405 ' HD2' ' HA ' ' A' ' 220' ' ' ASP . 53.5 Cg_endo -69.83 168.19 22.37 Favored 'Trans proline' 0 C--N 1.341 0.143 0 C-N-CA 122.732 2.288 . . . . 73.42 112.309 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -75.01 -44.96 45.11 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.182 -0.463 . . . . 74.21 110.909 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -127.3 -40.12 1.84 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.268 -0.424 . . . . 60.33 110.852 -179.924 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER 66.58 134.73 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.155 -0.475 . . . . 65.01 110.938 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -143.87 -167.9 2.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.087 -0.506 . . . . 64.24 110.919 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . 0.684 ' HB3' HD11 ' A' ' 231' ' ' ILE . 0.6 OUTLIER -59.56 149.2 30.73 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.262 -0.426 . . . . 53.44 110.939 179.885 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 227' ' ' SER . . . . . 0.48 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 1.4 t -86.93 154.84 20.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 74.21 110.932 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -62.82 -65.35 0.7 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.214 -0.448 . . . . 74.54 110.897 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -55.59 -26.09 41.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.225 -0.443 . . . . 72.22 110.863 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 230' ' ' ASP . . . . . 0.409 ' OD2' HG12 ' A' ' 211' ' ' VAL . 21.4 m-20 -69.64 -48.25 60.58 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.198 -0.456 . . . . 74.23 110.872 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 231' ' ' ILE . . . . . 0.704 HG23 ' HB3' ' A' ' 119' ' ' GLU . 8.6 mt -68.29 -42.82 84.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.171 -0.468 . . . . 73.41 111.211 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.21 -32.58 74.02 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.104 -0.498 . . . . 65.42 110.888 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -65.8 -48.3 68.01 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.748 -0.739 . . . . 63.43 112.495 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 234' ' ' ILE . . . . . 0.496 HD12 ' SD ' ' A' ' 202' ' ' MET . 11.8 tt -72.82 -30.61 33.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.79 0.328 . . . . 71.54 111.113 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -70.24 -24.03 63.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.147 -0.479 . . . . 70.33 110.907 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 236' ' ' LYS . . . . . 0.418 ' HE2' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.49 -27.29 60.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.199 -0.455 . . . . 51.21 110.908 179.974 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 237' ' ' LEU . . . . . 0.695 HD13 ' CE ' ' A' ' 83' ' ' LYS . 9.8 tt -98.03 -32.55 11.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.167 -0.47 . . . . 75.41 110.911 179.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 238' ' ' TYR . . . . . 0.438 ' CE2' HD11 ' A' ' 122' ' ' LEU . 32.4 m-85 -91.87 -35.18 14.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.2 -0.455 . . . . 51.24 110.917 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -113.0 -120.47 3.7 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.746 -0.74 . . . . 32.22 112.494 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 1.2 tmtm? -100.66 131.59 46.49 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.811 0.339 . . . . 75.42 110.839 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.15 146.25 23.72 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.194 -0.457 . . . . 73.34 110.829 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -161.27 27.44 0.13 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.191 -0.458 . . . . 62.42 110.866 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 65.14 152.48 0.05 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.148 -0.478 . . . . 72.13 110.823 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -179.57 -169.78 0.15 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.164 -0.471 . . . . 62.23 110.908 -179.862 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.63 166.04 16.17 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.158 -0.474 . . . . 70.43 110.886 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -152.11 162.91 40.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.273 -0.421 . . . . 72.11 110.85 -180.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 116.177 -0.465 . . . . 74.13 110.838 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 302' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' -2' ' ' LEU . . . . . 0.611 ' N ' ' HD2' ' A' ' -1' ' ' PRO . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.098 0 CA-C-O 121.6 0.714 . . . . 73.02 110.899 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' -1' ' ' PRO . . . . . 0.611 ' HD2' ' N ' ' A' ' -2' ' ' LEU . 53.7 Cg_endo -69.76 -172.98 0.63 Allowed 'Trans proline' 0 C--O 1.233 0.245 0 C-N-CA 122.729 2.286 . . . . 71.15 112.356 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 1.2 mp -122.24 160.64 46.9 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 121.594 0.712 . . . . 62.13 110.949 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.65 -11.97 32.11 Favored 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.687 2.258 . . . . 64.14 112.317 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -95.24 35.73 1.28 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.241 -0.436 . . . . 60.51 110.916 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -95.41 -27.99 15.16 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.247 -0.433 . . . . 74.01 110.836 -179.855 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -70.25 -34.18 72.52 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.135 -0.484 . . . . 71.4 111.114 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -55.99 -24.83 44.01 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.703 -0.76 . . . . 60.51 112.499 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -108.74 21.59 27.57 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.75 -0.738 . . . . 54.22 112.443 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 15.7 mtm -94.45 163.34 13.45 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.744 0.307 . . . . 72.23 110.922 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -115.52 168.83 9.66 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.308 -0.406 . . . . 73.24 110.871 -179.823 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -54.47 -31.8 56.44 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.157 -0.474 . . . . 50.12 110.9 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.48 -42.95 99.84 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.151 -0.477 . . . . 72.33 110.902 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.54 -41.22 98.47 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.163 -0.471 . . . . 72.14 110.896 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 5.4 t-105 -73.29 -33.6 65.31 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.159 -0.473 . . . . 71.22 110.933 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -73.31 -39.16 65.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.259 -0.428 . . . . 72.51 110.921 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 -74.05 -35.97 64.35 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.135 -0.484 . . . . 61.24 110.93 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.575 ' CB ' HD11 ' A' ' 59' ' ' ILE . . . -56.91 -44.16 82.13 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.225 -0.443 . . . . 54.34 111.123 179.894 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -73.53 -37.41 65.62 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.189 -0.46 . . . . 73.12 110.889 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -67.92 -30.98 70.44 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.174 -0.466 . . . . 72.4 110.93 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -69.95 -35.99 74.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.207 -0.451 . . . . 75.11 110.944 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.485 HD11 ' SD ' ' A' ' 42' ' ' MET . 0.4 OUTLIER -68.78 -20.93 64.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.17 -0.468 . . . . 72.51 110.923 179.985 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.405 ' HG2' ' N ' ' A' ' 21' ' ' ARG . 5.7 ptmt -74.85 -31.48 61.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.168 -0.469 . . . . 74.41 110.903 179.788 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.405 ' N ' ' HG2' ' A' ' 20' ' ' LYS . 2.2 ptp180 -86.37 -27.93 23.94 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.202 -0.454 . . . . 74.05 110.896 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.0 m-30 -77.82 -0.84 28.78 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.256 -0.429 . . . . 74.31 110.856 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.406 ' O ' ' HB2' ' A' ' 70' ' ' PRO . 2.9 m-85 -120.43 -75.34 0.59 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.112 -0.495 . . . . 72.55 110.946 -179.808 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.824 ' HG ' HG23 ' A' ' 72' ' ' VAL . 11.9 mt -160.93 155.37 23.31 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.147 -0.478 . . . . 75.43 110.934 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -82.61 89.16 6.68 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.264 -0.425 . . . . 71.41 110.9 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -125.19 131.34 53.21 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.104 -0.498 . . . . 74.25 110.911 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 84.7 p -85.15 -14.05 48.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.235 -0.439 . . . . 62.15 110.825 -179.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -70.03 -11.4 60.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.194 -0.457 . . . . 74.51 110.951 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.65 1.84 32.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.174 -0.466 . . . . 70.44 111.136 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 3.0 pttt -51.72 170.13 0.06 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.207 -0.451 . . . . 73.33 110.885 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.403 ' O ' HD23 ' A' ' 35' ' ' LEU . 6.4 m-20 67.14 123.54 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.224 -0.444 . . . . 64.43 110.863 179.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.47 ' HA ' HD23 ' A' ' 35' ' ' LEU . . . -61.18 -24.1 66.07 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.177 -0.465 . . . . 70.21 111.168 179.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -65.45 -32.28 73.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.21 -0.45 . . . . 35.31 110.884 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 11.0 m -85.56 -20.12 30.07 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.18 -0.464 . . . . 74.02 110.862 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.618 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 3.6 mm? -62.34 -35.83 80.32 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.15 -0.477 . . . . 72.52 110.901 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.472 ' HA ' HD12 ' A' ' 39' ' ' LEU . 0.9 OUTLIER -56.75 -50.37 72.46 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.165 -0.47 . . . . 73.13 110.88 179.916 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -52.64 -36.56 56.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.161 -0.472 . . . . 63.32 111.111 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.465 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.1 OUTLIER -70.7 -41.61 71.73 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.182 -0.463 . . . . 72.32 110.92 179.931 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.618 ' HG ' ' O ' ' A' ' 35' ' ' LEU . 25.4 mt -54.32 -38.05 65.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.215 -0.448 . . . . 72.11 110.951 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.0 mttt -58.72 -45.57 89.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.16 -0.473 . . . . 62.43 110.929 179.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.465 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 2.3 pt-20 -60.93 -32.68 72.17 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.219 -0.446 . . . . 75.11 110.912 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.707 ' HE1' HG13 ' A' ' 58' ' ' VAL . 4.5 ttt -66.83 -34.16 77.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.15 -0.477 . . . . 63.43 110.926 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.756 ' OE1' HD11 ' A' ' 48' ' ' LEU . 2.5 mm-40 -58.67 -40.05 82.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.455 . . . . 74.45 110.89 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.7 mmpt? -72.79 -33.49 66.3 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.233 -0.44 . . . . 71.43 110.875 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 32.7 t80 -71.0 -37.18 72.67 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.26 -0.427 . . . . 73.32 110.848 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.526 ' CB ' HD23 ' A' ' 48' ' ' LEU . 6.8 m-85 -81.78 -35.22 29.8 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.22 -0.446 . . . . 70.43 110.931 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 105.83 -10.34 44.76 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.748 -0.739 . . . . 64.34 112.509 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.756 HD11 ' OE1' ' A' ' 43' ' ' GLN . 0.9 OUTLIER -66.0 135.79 95.35 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.619 0.723 . . . . 64.11 110.898 -179.906 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.76 -52.9 0.3 Allowed 'Trans proline' 0 C--N 1.342 0.228 0 C-N-CA 122.697 2.264 . . . . 74.5 112.325 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.455 ' O ' HD12 ' A' ' 48' ' ' LEU . 0.9 OUTLIER -52.67 108.22 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.205 -0.452 . . . . 71.22 111.13 179.949 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.687 HG22 ' CB ' ' A' ' 43' ' ' GLN . 21.1 p -107.88 168.09 9.52 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.165 -0.47 . . . . 73.25 111.126 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 60.16 16.92 43.49 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.688 -0.768 . . . . 64.24 112.494 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.568 ' O ' HG21 ' A' ' 58' ' ' VAL . 1.0 OUTLIER -128.12 134.02 49.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.772 0.32 . . . . 75.23 110.844 -179.907 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.43 ' HA ' ' HB ' ' A' ' 58' ' ' VAL . 24.6 tp -145.36 93.1 2.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.193 -0.458 . . . . 73.4 110.892 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.6 p30 174.38 -29.68 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.219 -0.446 . . . . 44.35 110.925 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 24.1 t -83.86 -97.68 0.06 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.151 -0.477 . . . . 75.25 110.833 -179.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 8.8 tpt180 -85.09 -33.05 22.5 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.14 -0.482 . . . . 61.22 110.949 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.707 HG13 ' HE1' ' A' ' 42' ' ' MET . 44.7 t -59.06 -49.34 83.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.191 -0.459 . . . . 70.12 111.148 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.575 HD11 ' CB ' ' A' ' 15' ' ' ALA . 0.5 OUTLIER -63.99 -30.9 51.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.162 -0.472 . . . . 74.43 111.082 179.913 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.01 -40.4 84.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.261 -0.427 . . . . 73.45 110.931 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.689 HD13 HG22 ' A' ' 215' ' ' THR . 0.8 OUTLIER -78.26 -30.1 15.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.133 -0.485 . . . . 74.52 111.144 179.937 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 7.9 mmm -68.18 -35.14 77.55 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.181 -0.463 . . . . 74.01 110.893 179.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -83.87 -24.33 30.91 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.182 -0.463 . . . . 42.22 110.918 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.25 148.48 50.11 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.54 0.686 . . . . 65.34 110.958 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.8 154.22 67.85 Favored 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.663 2.242 . . . . 72.11 112.344 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 40.9 ttp180 -153.38 -84.02 0.07 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.225 -0.443 . . . . 71.51 110.872 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -145.48 156.19 43.57 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.178 -0.465 . . . . 55.3 110.925 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.527 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -100.12 20.55 48.39 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.701 -0.762 . . . . 64.23 112.488 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.763 HG12 ' HD2' ' A' ' 70' ' ' PRO . 0.0 OUTLIER -111.29 141.88 25.28 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.725 0.774 . . . . 74.23 111.122 179.979 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.763 ' HD2' HG12 ' A' ' 69' ' ' VAL . 54.4 Cg_endo -69.71 139.02 39.36 Favored 'Trans proline' 0 C--N 1.342 0.207 0 C-N-CA 122.736 2.291 . . . . 63.44 112.349 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 87.7 m-20 -61.55 -17.01 53.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.191 -0.459 . . . . 74.45 110.89 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.824 HG23 ' HG ' ' A' ' 24' ' ' LEU . 0.3 OUTLIER -139.96 129.01 27.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.186 -0.461 . . . . 53.43 111.165 179.986 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -131.78 151.8 51.4 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.179 -0.464 . . . . 73.13 111.119 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 172.33 87.77 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.233 -0.44 . . . . 73.31 110.921 -179.948 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 28.0 p90 -175.13 170.16 3.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.131 -0.486 . . . . 70.41 110.944 -179.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.445 ' O ' ' OG ' ' A' ' 76' ' ' SER . 2.4 p 64.53 100.43 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.138 -0.483 . . . . 74.2 110.859 -179.828 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.446 HD22 ' OG1' ' A' ' 164' ' ' THR . 0.1 OUTLIER 73.84 -42.11 0.51 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.087 -0.506 . . . . 70.34 110.897 179.952 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . 0.406 ' H ' ' C ' ' A' ' 76' ' ' SER . 47.1 m-85 61.74 66.71 1.45 Allowed Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.592 0.71 . . . . 71.24 110.906 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.429 ' HG3' ' HA3' ' A' ' 163' ' ' GLY . 54.0 Cg_endo -69.75 -174.86 0.98 Allowed 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.634 2.223 . . . . 73.34 112.359 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 50.6 m-80 -118.0 148.28 42.38 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.202 -0.454 . . . . 74.43 110.853 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.3 t 65.1 115.42 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.615 0.722 . . . . 70.4 110.838 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.86 -37.97 8.22 Favored 'Trans proline' 0 C--O 1.231 0.125 0 C-N-CA 122.714 2.276 . . . . 71.11 112.29 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.697 ' HD2' HD22 ' A' ' 237' ' ' LEU . 1.9 mttp -82.33 163.35 21.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.24 -0.436 . . . . 64.45 110.905 179.874 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . 0.502 ' CD1' ' HA ' ' A' ' 200' ' ' LEU . 47.0 m95 -62.95 135.2 57.17 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.226 -0.443 . . . . 73.31 110.955 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.35 1.37 13.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.303 -0.408 . . . . 65.3 111.154 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -77.81 163.71 25.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.152 -0.476 . . . . 70.34 110.908 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.72 -6.81 59.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.156 -0.475 . . . . 71.12 110.929 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.438 HG23 ' CD2' ' A' ' 123' ' ' HIS . 0.3 OUTLIER -170.51 138.83 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.206 -0.452 . . . . 74.14 111.141 179.9 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 95.9 t -123.39 135.62 62.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.234 -0.439 . . . . 72.25 111.088 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.693 HG22 ' HB3' ' A' ' 125' ' ' ARG . 9.5 p -115.07 168.1 10.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.155 -0.475 . . . . 71.01 111.142 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.404 ' N ' ' CD1' ' A' ' 91' ' ' TYR . 2.9 p90 -144.58 147.42 33.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.18 -0.464 . . . . 70.51 110.947 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.408 ' CB ' ' HB3' ' A' ' 132' ' ' ALA . 5.4 tpt85 -148.03 134.72 19.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.138 -0.483 . . . . 71.25 110.871 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.437 HD11 ' HA ' ' A' ' 106' ' ' ASP . 10.2 mm -77.21 135.32 26.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.183 -0.462 . . . . 72.4 111.128 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.473 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 18.3 t -93.98 -40.5 11.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.22 -0.445 . . . . 60.2 111.138 179.857 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -151.63 169.56 21.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.081 -0.509 . . . . 64.24 110.848 -179.865 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 16.1 p90 -130.12 155.24 46.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.141 -0.481 . . . . 72.25 110.971 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.5 t -100.64 142.19 32.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 64.11 111.136 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -52.08 -18.46 1.44 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.215 -0.448 . . . . 72.14 110.859 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.97 -36.7 85.23 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.186 -0.461 . . . . 74.13 110.863 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.435 HD23 HG21 ' A' ' 104' ' ' THR . 1.7 mp -144.07 152.81 55.72 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-O 121.623 0.725 . . . . 72.52 110.934 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . 0.57 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.7 Cg_endo -69.83 151.27 68.6 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.662 2.241 . . . . 73.11 112.319 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 2.7 t-160 -50.8 -28.3 9.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.18 -0.464 . . . . 74.11 110.88 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.57 HG22 ' HB2' ' A' ' 101' ' ' PRO . 2.7 tp -75.65 -38.32 37.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.205 -0.452 . . . . 74.02 111.068 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . 0.771 ' O ' HD22 ' A' ' 108' ' ' LEU . 3.1 m -69.21 -37.88 78.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.168 -0.469 . . . . 52.11 111.125 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.805 ' O ' HG13 ' A' ' 109' ' ' VAL . 65.5 t -71.68 -44.48 69.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.214 -0.448 . . . . 71.51 111.15 179.885 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.648 ' O ' HG22 ' A' ' 109' ' ' VAL . 26.9 t0 -63.96 -38.55 91.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 63.44 110.85 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . 0.498 ' HG3' ' N ' ' A' ' 108' ' ' LEU . 0.0 OUTLIER -70.55 -33.44 71.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.189 -0.46 . . . . 75.02 110.875 -179.89 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.771 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -66.21 -48.55 70.25 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.201 -0.454 . . . . 71.04 110.922 -179.993 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.805 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.5 m -55.01 -43.17 68.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.189 -0.459 . . . . 72.31 111.06 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.487 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 45.3 t -70.65 -33.93 71.49 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.194 -0.457 . . . . 72.14 110.869 -179.789 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.48 ' HB3' HD21 ' A' ' 189' ' ' LEU . 0.3 OUTLIER -62.1 -33.17 73.94 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.087 -0.506 . . . . 74.35 110.928 179.927 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.71 -40.27 9.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.244 -0.434 . . . . 74.32 111.135 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.788 HD12 HD12 ' A' ' 196' ' ' LEU . 0.4 OUTLIER -64.32 -33.04 74.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.135 -0.484 . . . . 72.0 110.915 179.981 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 45.0 t30 -69.82 -40.14 76.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.174 -0.466 . . . . 72.34 110.876 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . 0.441 ' HB3' HD23 ' A' ' 226' ' ' LEU . 0.4 OUTLIER -59.71 -34.33 72.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.163 -0.471 . . . . 54.12 110.921 179.905 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' TRP . . . . . 0.554 ' CZ3' HD11 ' A' ' 226' ' ' LEU . 13.3 m95 -65.8 -52.24 52.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.223 -0.444 . . . . 75.23 110.922 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . 0.447 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -63.52 -34.01 88.8 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.694 -0.765 . . . . 73.32 112.497 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.4 mtmt -63.67 -14.44 52.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.752 0.31 . . . . 72.42 110.892 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.425 ' HB3' HG23 ' A' ' 231' ' ' ILE . 61.2 mm-40 -104.04 13.27 32.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.233 -0.44 . . . . 75.24 110.894 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 1.01 HD12 HD12 ' A' ' 122' ' ' LEU . 6.7 pt -147.71 153.13 42.58 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.653 0.74 . . . . 71.34 111.149 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 1.99 3.91 Favored 'Trans proline' 0 C--N 1.342 0.226 0 C-N-CA 122.658 2.239 . . . . 72.21 112.362 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 1.01 HD12 HD12 ' A' ' 120' ' ' ILE . 5.9 mt -61.46 -158.25 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.208 -0.451 . . . . 73.22 110.885 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.438 ' CD2' HG23 ' A' ' 88' ' ' VAL . 5.0 t60 -160.15 145.05 14.82 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.116 -0.493 . . . . 74.12 110.843 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . 0.5 ' CD2' HD21 ' A' ' 113' ' ' LEU . 42.4 m-85 -126.08 148.94 49.23 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.174 -0.466 . . . . 75.54 110.882 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.693 ' HB3' HG22 ' A' ' 90' ' ' THR . 0.0 OUTLIER -128.01 140.96 51.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.16 -0.473 . . . . 75.14 110.857 -179.921 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.401 ' HD3' ' N ' ' A' ' 127' ' ' VAL . 0.0 OUTLIER -81.01 141.19 34.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 72.22 110.869 179.988 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . 0.952 HG11 ' HB2' ' A' ' 132' ' ' ALA . 22.2 m -102.92 133.79 45.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.214 -0.448 . . . . 50.13 111.177 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.427 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -147.06 -24.83 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.191 -0.459 . . . . 74.43 111.19 179.886 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' TRP . . . . . 0.427 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -136.72 109.15 7.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.117 -0.492 . . . . 71.25 110.885 179.972 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.44 -159.74 14.39 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.756 -0.735 . . . . 62.11 112.482 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -101.8 155.54 18.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.786 0.326 . . . . 63.25 111.168 -179.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . 0.952 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -112.07 165.38 12.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.2 -0.455 . . . . 51.34 111.083 179.86 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -66.48 -62.8 1.27 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.191 -0.459 . . . . 75.41 110.853 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . 0.494 HG23 ' HA ' ' A' ' 169' ' ' ASP . 37.6 mt -86.41 130.48 36.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.211 -0.45 . . . . 70.51 111.143 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . 0.473 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 13.7 mmm -107.06 124.9 50.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.12 -0.491 . . . . 72.43 110.914 179.877 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -108.52 92.29 2.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.23 -0.441 . . . . 70.04 111.096 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . 0.429 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -130.31 170.15 20.99 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.738 -0.744 . . . . 63.34 112.497 179.865 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' PHE . . . . . 0.462 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 48.2 m-85 -108.61 149.62 28.65 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.875 0.369 . . . . 74.01 110.938 -179.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.606 ' HB1' ' CB ' ' A' ' 143' ' ' HIS . . . 175.83 166.91 0.39 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.456 . . . . 71.21 111.1 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 22.2 mtm180 -104.26 173.09 6.45 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.214 -0.448 . . . . 62.21 110.908 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -58.09 -15.73 23.04 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.722 -0.751 . . . . 74.24 112.466 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -99.05 13.36 33.09 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.769 0.319 . . . . 75.03 111.165 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . 0.606 ' CB ' ' HB1' ' A' ' 139' ' ' ALA . 5.0 p80 -72.26 -8.86 57.13 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.172 -0.467 . . . . 71.11 110.843 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 117.95 50.38 0.35 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.773 -0.727 . . . . 45.51 112.55 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -172.7 171.86 4.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.808 0.337 . . . . 72.14 110.911 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 27.1 p -64.09 -179.79 0.46 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.18 -0.464 . . . . 51.25 110.849 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' TYR . . . . . 0.44 ' HA ' ' HD2' ' A' ' 148' ' ' PRO . 0.3 OUTLIER 64.48 103.92 0.03 OUTLIER Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.727 0.775 . . . . 73.4 110.949 -179.905 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . 0.44 ' HD2' ' HA ' ' A' ' 147' ' ' TYR . 54.2 Cg_endo -69.77 151.97 69.17 Favored 'Trans proline' 0 C--N 1.342 0.228 0 C-N-CA 122.612 2.208 . . . . 74.53 112.372 179.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 149' ' ' PHE . . . . . 0.404 ' O ' ' CG ' ' A' ' 150' ' ' ASP . 0.3 OUTLIER -53.38 -24.26 11.83 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.166 -0.47 . . . . 63.52 110.842 -179.942 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . 0.404 ' CG ' ' O ' ' A' ' 149' ' ' PHE . 1.9 p30 44.93 25.43 0.15 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.191 -0.459 . . . . 63.11 110.861 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 44.69 -165.05 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.719 -0.753 . . . . 71.41 112.48 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.72 144.36 53.98 Favored 'Trans proline' 0 C--N 1.343 0.24 0 C-N-CA 122.632 2.222 . . . . 75.11 112.36 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . 0.457 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 105.57 -131.76 10.8 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.775 -0.726 . . . . 70.32 112.445 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 154' ' ' ASN . . . . . 0.457 ' C ' ' O ' ' A' ' 153' ' ' GLY . 3.5 p30 -33.37 135.82 0.11 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.851 0.358 . . . . 73.25 110.891 -179.875 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 155' ' ' THR . . . . . 0.524 HG23 ' HA2' ' A' ' 68' ' ' GLY . 0.2 OUTLIER 74.24 101.88 0.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.234 -0.439 . . . . 44.41 111.189 -179.965 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . 1.045 HD21 HG21 ' A' ' 186' ' ' ILE . 0.4 OUTLIER -82.41 -56.89 3.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.16 -0.473 . . . . 75.02 110.94 179.98 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . 0.527 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -162.87 149.09 12.39 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.245 -0.434 . . . . 71.42 111.131 179.769 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 18.9 p-80 -105.19 126.09 51.71 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.267 -0.424 . . . . 72.02 110.809 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -110.53 153.06 25.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.181 -0.463 . . . . 74.42 111.105 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 15.1 m-85 -108.55 152.25 25.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.23 -0.441 . . . . 75.31 110.877 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . 0.712 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -96.66 164.16 18.75 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.617 0.722 . . . . 61.04 111.112 179.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 162' ' ' PRO . . . . . 0.712 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.5 Cg_endo -69.76 85.33 0.62 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.672 2.248 . . . . 74.44 112.361 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 163' ' ' GLY . . . . . 0.429 ' HA3' ' HG3' ' A' ' 79' ' ' PRO . . . -134.57 127.63 4.55 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.718 -0.753 . . . . 61.41 112.462 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 164' ' ' THR . . . . . 0.446 ' OG1' HD22 ' A' ' 77' ' ' LEU . 2.7 m 72.72 -69.78 0.18 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.847 0.356 . . . . 73.1 111.102 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . 166.61 -59.44 0.23 Allowed Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.767 -0.73 . . . . 74.03 112.454 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 166' ' ' LEU . . . . . 0.484 ' C ' HD23 ' A' ' 166' ' ' LEU . 8.7 tt -53.99 -37.7 64.29 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.741 0.305 . . . . 65.12 110.891 -179.915 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -73.98 -166.19 13.21 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.68 -0.772 . . . . 43.43 112.519 179.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 73.01 18.04 78.93 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.642 -0.789 . . . . 74.31 112.483 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 169' ' ' ASP . . . . . 0.494 ' HA ' HG23 ' A' ' 134' ' ' ILE . 74.9 m-20 -91.97 -172.4 3.15 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.796 0.331 . . . . 63.41 110.824 -179.876 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -124.47 131.36 53.49 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.19 -0.459 . . . . 74.21 111.116 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 171' ' ' HIS . . . . . 0.502 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 10.9 m170 -129.0 137.91 51.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.216 -0.447 . . . . 72.53 110.809 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 47.1 m-85 -121.55 140.33 52.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.208 -0.451 . . . . 71.44 110.899 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 55.6 t0 -73.47 100.84 3.35 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.203 -0.453 . . . . 74.11 110.902 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.83 -16.42 11.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.115 -0.493 . . . . 72.25 110.86 -179.886 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -79.03 -16.37 56.94 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.125 -0.489 . . . . 73.32 110.875 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 31.4 mm-40 -83.48 -175.79 5.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.194 -0.457 . . . . 63.2 110.824 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -112.18 116.53 30.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.136 -0.484 . . . . 63.14 110.857 -179.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 49.6 m95 -116.82 139.41 50.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.176 -0.466 . . . . 72.31 110.947 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 179' ' ' THR . . . . . 0.515 HG21 ' HB3' ' A' ' 182' ' ' SER . 9.0 t -177.46 163.6 1.99 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.221 -0.445 . . . . 74.13 111.231 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -125.12 -68.86 0.82 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.241 -0.436 . . . . 45.33 110.852 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -64.81 -12.15 52.59 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.706 -0.759 . . . . 62.41 112.523 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 182' ' ' SER . . . . . 0.515 ' HB3' HG21 ' A' ' 179' ' ' THR . 0.4 OUTLIER -94.52 -24.44 17.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.925 0.393 . . . . 64.5 110.876 -179.743 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 183' ' ' SER . . . . . 0.425 ' C ' ' O ' ' A' ' 182' ' ' SER . 3.2 p 35.32 58.03 0.82 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.103 -0.499 . . . . 64.12 110.894 -179.821 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -116.85 -33.53 4.75 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.101 -0.5 . . . . 74.2 110.915 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -119.79 -139.37 5.9 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.696 -0.764 . . . . 73.01 112.414 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 186' ' ' ILE . . . . . 1.045 HG21 HD21 ' A' ' 156' ' ' LEU . 6.9 mm -79.47 100.08 3.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.864 0.364 . . . . 73.22 111.118 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 28.6 m-20 -49.19 121.7 5.18 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.195 -0.457 . . . . 71.31 110.944 179.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 188' ' ' PHE . . . . . 0.773 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.5 t80 -54.03 -36.25 62.83 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.196 -0.456 . . . . 75.45 110.884 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . 0.59 HD12 ' HE2' ' A' ' 224' ' ' PHE . 0.2 OUTLIER -67.57 -47.62 69.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.139 -0.482 . . . . 52.02 110.867 -179.934 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 44.3 t80 -69.48 -38.94 77.92 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.256 -0.429 . . . . 74.22 110.901 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 191' ' ' ALA . . . . . 0.671 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -72.13 -35.23 69.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.154 -0.475 . . . . 50.03 111.133 179.894 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 192' ' ' ALA . . . . . 0.641 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -57.12 -45.02 83.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.161 -0.472 . . . . 52.11 111.031 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.97 -42.71 90.58 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.231 -0.44 . . . . 72.43 111.181 -179.886 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 15.0 t-160 -73.21 -38.56 66.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.228 -0.442 . . . . 71.44 110.909 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -75.38 -48.51 22.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 71.01 111.052 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 196' ' ' LEU . . . . . 0.788 HD12 HD12 ' A' ' 113' ' ' LEU . 4.5 mm? -63.81 -40.02 95.63 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.236 -0.438 . . . . 74.51 110.943 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -58.91 -28.59 63.65 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.742 -0.742 . . . . 52.23 112.436 179.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 198' ' ' HIS . . . . . 0.473 ' CD2' HG21 ' A' ' 69' ' ' VAL . 7.1 m-70 -69.29 -32.42 71.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.738 0.304 . . . . 75.21 110.793 -179.892 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -70.94 -21.26 62.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.207 -0.451 . . . . 71.13 110.874 -179.748 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 200' ' ' LEU . . . . . 0.502 ' HA ' ' CD1' ' A' ' 84' ' ' TRP . 0.3 OUTLIER -92.54 4.82 52.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.099 -0.501 . . . . 64.13 110.938 -179.984 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 83.37 -9.52 61.23 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.735 -0.745 . . . . 50.41 112.473 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 202' ' ' MET . . . . . 0.434 ' HE2' ' HB3' ' A' ' 202' ' ' MET . 0.0 OUTLIER -54.83 135.0 48.23 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.88 0.372 . . . . 63.21 110.854 -179.99 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -109.79 159.22 14.08 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.768 -0.73 . . . . 64.44 112.409 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 12.4 m-70 -52.47 155.78 2.02 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.88 0.371 . . . . 74.32 110.837 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 205' ' ' SER . . . . . 0.427 ' HB2' ' HB1' ' A' ' 210' ' ' ALA . 0.5 OUTLIER -117.27 153.01 33.67 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.182 -0.463 . . . . 53.34 110.855 -179.784 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 5.2 p -87.73 -4.9 58.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.157 -0.474 . . . . 72.22 110.859 -179.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -71.65 140.53 84.26 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.657 0.741 . . . . 65.11 110.886 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.82 -6.32 18.34 Favored 'Trans proline' 0 C--N 1.342 0.21 0 C-N-CA 122.693 2.262 . . . . 74.53 112.332 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 2.9 p30 -126.85 32.25 5.15 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.23 -0.441 . . . . 63.52 110.874 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 210' ' ' ALA . . . . . 0.492 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.11 146.07 26.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 62.23 111.103 179.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -73.63 -27.09 22.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 62.04 111.148 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 3.2 mmm -97.54 14.1 27.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.194 -0.457 . . . . 75.22 110.876 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 213' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -55.23 121.98 40.23 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-O 121.612 0.72 . . . . 73.43 110.992 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.73 -18.79 36.94 Favored 'Trans proline' 0 N--CA 1.465 -0.203 0 C-N-CA 122.716 2.278 . . . . 63.01 112.364 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 215' ' ' THR . . . . . 0.689 HG22 HD13 ' A' ' 61' ' ' ILE . 5.9 p -84.37 53.28 2.59 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.247 -0.433 . . . . 74.24 111.14 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 8.0 t80 -70.73 122.72 20.36 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.224 -0.444 . . . . 74.14 110.955 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -111.81 171.28 14.12 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.718 -0.754 . . . . 74.22 112.387 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -58.25 -56.23 24.71 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.89 0.376 . . . . 64.22 110.902 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . -51.71 102.9 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.785 -0.722 . . . . 72.24 112.474 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 220' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -95.52 153.6 39.46 Favored Pre-proline 0 C--N 1.327 -0.389 0 CA-C-O 121.559 0.695 . . . . 41.43 110.855 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 221' ' ' PRO . . . . . 0.421 ' HG2' ' HB3' ' A' ' 224' ' ' PHE . 52.9 Cg_endo -69.86 168.99 20.11 Favored 'Trans proline' 0 C--O 1.231 0.15 0 C-N-CA 122.662 2.241 . . . . 73.42 112.279 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 4.7 mm100 -70.02 -45.43 67.23 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.212 -0.449 . . . . 74.21 110.913 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -130.24 -40.45 1.29 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.196 -0.456 . . . . 60.33 110.883 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 224' ' ' PHE . . . . . 0.59 ' HE2' HD12 ' A' ' 189' ' ' LEU . 0.0 OUTLIER 65.58 136.66 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.186 -0.461 . . . . 65.01 110.848 179.987 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -143.99 -178.19 5.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.185 -0.461 . . . . 64.24 110.875 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . 0.867 ' HB3' HD11 ' A' ' 231' ' ' ILE . 0.7 OUTLIER -59.71 148.02 35.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 53.44 110.909 179.925 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 227' ' ' SER . . . . . 0.492 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 1.4 t -90.71 151.62 21.16 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.198 -0.455 . . . . 74.21 110.826 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 42.6 tt0 -67.46 -60.7 2.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.088 -0.505 . . . . 74.54 110.958 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -58.36 -26.08 62.75 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.214 -0.448 . . . . 72.22 110.865 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -69.78 -48.82 57.82 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.19 -0.459 . . . . 74.23 110.904 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 231' ' ' ILE . . . . . 0.867 HD11 ' HB3' ' A' ' 226' ' ' LEU . 10.5 mt -68.63 -44.83 82.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 73.41 111.153 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.2 -32.77 66.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.176 -0.466 . . . . 65.42 110.902 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -64.26 -49.79 63.99 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.703 -0.76 . . . . 63.43 112.456 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 234' ' ' ILE . . . . . 0.492 HD13 HG21 ' A' ' 120' ' ' ILE . 12.8 tt -73.15 -31.82 36.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.72 0.295 . . . . 71.54 111.115 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -62.65 -24.3 67.54 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.142 -0.481 . . . . 70.33 110.895 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 236' ' ' LYS . . . . . 0.449 ' HE3' ' HB2' ' A' ' 237' ' ' LEU . 0.1 OUTLIER -74.66 -22.11 59.06 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.2 -0.455 . . . . 51.21 110.868 179.994 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 237' ' ' LEU . . . . . 0.697 HD22 ' HD2' ' A' ' 83' ' ' LYS . 10.6 tt -97.34 -33.73 11.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.206 -0.452 . . . . 75.41 110.926 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 238' ' ' TYR . . . . . . . . . . . . . 47.4 m-85 -92.04 -35.31 14.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.174 -0.466 . . . . 51.24 110.902 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -129.38 -120.01 2.21 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.709 -0.757 . . . . 32.22 112.508 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 15.9 tttm -129.27 120.3 25.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.777 0.322 . . . . 75.42 110.922 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 1.2 tpt85 -175.03 -172.03 0.57 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.264 -0.426 . . . . 73.34 110.862 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -134.5 -174.39 3.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.171 -0.468 . . . . 62.42 110.805 -179.715 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 60.39 95.8 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.129 -0.487 . . . . 72.13 110.879 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 44.3 t -120.72 104.73 10.13 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.168 -0.469 . . . . 62.23 110.875 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 1.5 ttm180 -111.99 58.34 0.63 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.135 -0.484 . . . . 70.43 110.876 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -103.76 134.01 47.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.21 -0.45 . . . . 72.11 110.915 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 15.2 mmtt . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.237 -0.438 . . . . 74.13 110.93 179.857 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 302' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' -2' ' ' LEU . . . . . 0.753 ' H3 ' HD22 ' A' ' -2' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.153 0 CA-C-O 121.511 0.672 . . . . 73.02 111.011 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' -1' ' ' PRO . . . . . 0.632 ' C ' HD13 ' A' ' 0' ' ' LEU . 53.9 Cg_endo -69.69 -170.96 0.42 Allowed 'Trans proline' 0 C--O 1.231 0.131 0 C-N-CA 122.728 2.285 . . . . 71.15 112.303 179.893 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 0' ' ' LEU . . . . . 0.706 HD13 ' N ' ' A' ' 0' ' ' LEU . 0.0 OUTLIER -150.14 63.04 5.93 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.627 0.727 . . . . 62.13 110.908 179.881 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.72 -174.26 0.87 Allowed 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.722 2.281 . . . . 64.14 112.311 179.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -133.56 74.71 1.57 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.163 -0.471 . . . . 60.51 110.877 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -95.08 -24.66 16.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.213 -0.449 . . . . 74.01 110.848 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.47 -33.94 66.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.161 -0.472 . . . . 71.4 111.146 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -55.85 -27.27 49.85 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.73 -0.748 . . . . 60.51 112.552 -180.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -108.73 19.64 30.53 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.725 -0.75 . . . . 54.22 112.491 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.82 154.86 31.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.828 0.347 . . . . 72.23 110.87 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -115.6 168.76 9.73 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.2 -0.454 . . . . 73.24 110.865 -179.852 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -54.55 -33.14 59.61 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.15 -0.477 . . . . 50.12 110.911 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.49 -42.78 78.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.153 -0.476 . . . . 72.33 110.876 -179.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -65.88 -41.13 91.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.228 -0.442 . . . . 72.14 110.879 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.515 ' CE2' HD23 ' A' ' 54' ' ' LEU . 16.0 t-105 -72.83 -44.31 61.58 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.192 -0.458 . . . . 71.22 110.86 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 78.4 tt0 -62.31 -35.25 78.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.222 -0.445 . . . . 72.51 110.814 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 64.0 mm-40 -74.24 -36.61 63.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.171 -0.468 . . . . 61.24 110.914 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.89 -43.78 78.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.202 -0.453 . . . . 54.34 111.125 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.761 ' HB3' HD21 ' A' ' 35' ' ' LEU . 0.0 OUTLIER -73.07 -32.18 64.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.182 -0.463 . . . . 73.12 110.933 -179.938 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 83.4 m-20 -77.66 -30.91 52.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.174 -0.466 . . . . 72.4 110.898 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.97 -35.69 75.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.153 -0.476 . . . . 75.11 110.938 -179.848 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.661 HD13 ' O ' ' A' ' 19' ' ' LEU . 3.0 tm? -71.26 -21.41 62.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.118 -0.492 . . . . 72.51 110.92 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 4.1 ptmt -75.32 -28.6 59.72 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.188 -0.46 . . . . 74.41 110.919 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.8 ptp180 -86.36 -27.11 24.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.213 -0.448 . . . . 74.05 110.912 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -59.67 -25.32 64.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.181 -0.463 . . . . 74.31 110.877 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.566 ' HB3' HG21 ' A' ' 72' ' ' VAL . 14.5 m-85 -92.26 -74.05 0.53 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.125 -0.489 . . . . 72.55 110.924 -179.876 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 83.4 mt -154.43 18.31 0.47 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.077 -0.511 . . . . 75.43 110.865 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 4.1 t80 47.99 89.76 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.191 -0.459 . . . . 71.41 110.891 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -125.06 128.44 48.5 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.123 -0.489 . . . . 74.25 110.845 179.913 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.3 p -74.14 -6.41 47.51 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.197 -0.456 . . . . 62.15 110.871 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.92 -13.11 55.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.115 -0.493 . . . . 74.51 110.888 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.435 HG22 ' O ' ' A' ' 29' ' ' THR . 4.5 m -85.18 8.32 18.71 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.165 -0.471 . . . . 70.44 111.15 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -51.09 169.49 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.198 -0.455 . . . . 73.33 110.844 179.944 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 33.1 t30 65.05 154.38 0.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.178 -0.464 . . . . 64.43 110.861 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.99 -20.21 59.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.177 -0.465 . . . . 70.21 111.134 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -56.77 -25.39 55.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.169 -0.469 . . . . 35.31 110.91 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 4.1 m -85.7 -22.12 27.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.182 -0.463 . . . . 74.02 110.905 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.761 HD21 ' HB3' ' A' ' 16' ' ' GLN . 0.2 OUTLIER -62.53 -44.85 95.34 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.124 -0.489 . . . . 72.52 110.916 179.97 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.4 -51.38 63.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.222 -0.444 . . . . 73.13 110.849 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.28 -51.17 68.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.159 -0.473 . . . . 63.32 111.06 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 5.1 mmtt -59.74 -49.48 77.56 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.209 -0.45 . . . . 72.32 110.917 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.461 ' CD2' HD23 ' A' ' 35' ' ' LEU . 0.1 OUTLIER -55.19 -38.74 68.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 72.11 110.964 179.892 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.38 -46.49 88.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 62.43 111.005 179.751 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -70.39 -37.06 74.45 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.173 -0.467 . . . . 75.11 110.925 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 3.2 ttt -68.73 -46.0 70.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.197 -0.456 . . . . 63.43 110.893 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.626 ' HG2' HD11 ' A' ' 48' ' ' LEU . 18.5 mt-30 -57.31 -43.5 83.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.235 -0.439 . . . . 74.45 110.921 179.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.6 mmpt? -69.14 -26.73 65.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.213 -0.449 . . . . 71.43 110.86 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -69.99 -36.25 75.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.26 -0.427 . . . . 73.32 110.926 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.561 ' HB3' HD23 ' A' ' 48' ' ' LEU . 6.1 m-85 -80.48 -30.65 37.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.115 -0.493 . . . . 70.43 110.85 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 105.55 -10.55 46.04 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.749 -0.739 . . . . 64.34 112.465 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.626 HD11 ' HG2' ' A' ' 43' ' ' GLN . 0.6 OUTLIER -63.13 140.06 97.62 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.576 0.703 . . . . 64.11 110.938 -179.881 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.75 -51.9 0.36 Allowed 'Trans proline' 0 C--O 1.231 0.169 0 C-N-CA 122.669 2.246 . . . . 74.5 112.325 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.587 HD13 ' HB2' ' A' ' 56' ' ' SER . 0.7 OUTLIER -48.82 108.21 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.238 -0.437 . . . . 71.22 111.146 179.936 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 1.8 t -111.28 159.33 18.04 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.167 -0.47 . . . . 73.25 111.054 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 58.37 17.07 30.71 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.799 -0.715 . . . . 64.24 112.49 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.2 mtp -127.49 161.05 29.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.823 0.344 . . . . 75.23 110.828 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.515 HD23 ' CE2' ' A' ' 12' ' ' TRP . 20.4 tp -154.38 96.81 1.96 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.223 -0.444 . . . . 73.4 110.944 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 177.51 -32.13 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.2 -0.454 . . . . 44.35 110.933 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . 0.587 ' HB2' HD13 ' A' ' 50' ' ' ILE . 5.0 m -79.51 -100.71 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.162 -0.472 . . . . 75.25 110.795 -179.834 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.0 mmt85 -84.82 -29.4 25.39 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.166 -0.47 . . . . 61.22 110.864 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.517 HG23 HD12 ' A' ' 50' ' ' ILE . 16.3 t -58.84 -44.06 89.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.234 -0.439 . . . . 70.12 111.124 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.416 HD13 ' HA ' ' A' ' 59' ' ' ILE . 3.4 mm -75.51 -31.31 23.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.19 -0.459 . . . . 74.43 111.116 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.94 -44.55 92.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.148 -0.478 . . . . 73.45 110.874 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.428 HD12 ' CZ ' ' A' ' 46' ' ' PHE . 30.3 pt -64.9 -29.89 48.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.196 -0.456 . . . . 74.52 111.117 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 8.1 mmt -65.16 -36.88 85.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.227 -0.442 . . . . 74.01 110.909 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -90.59 -24.59 20.51 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.177 -0.465 . . . . 42.22 110.948 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 2.8 tppt? -84.88 130.76 51.35 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.552 0.692 . . . . 65.34 110.961 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 126.08 12.89 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.657 2.238 . . . . 72.11 112.36 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.42 ' O ' HD23 ' A' ' 156' ' ' LEU . 19.7 ttp180 -122.18 -84.67 0.66 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.191 -0.459 . . . . 71.51 110.883 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -145.96 147.46 31.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.18 -0.464 . . . . 55.3 110.891 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.59 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -98.41 20.85 48.8 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.74 -0.743 . . . . 64.23 112.518 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.516 HG21 ' CD2' ' A' ' 198' ' ' HIS . 0.1 OUTLIER -109.62 130.83 22.35 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.609 0.719 . . . . 74.23 111.165 179.999 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.466 ' HB3' ' O ' ' A' ' 23' ' ' TYR . 54.3 Cg_endo -69.79 159.39 53.56 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.647 2.231 . . . . 63.44 112.367 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -113.52 28.62 8.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.237 -0.438 . . . . 74.45 110.872 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.566 HG21 ' HB3' ' A' ' 23' ' ' TYR . 3.2 m -127.32 129.21 70.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.165 -0.471 . . . . 53.43 111.163 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -131.05 170.45 14.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.156 -0.475 . . . . 73.13 111.139 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -146.59 113.84 6.25 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.244 -0.435 . . . . 73.31 110.967 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 29.6 t80 -51.61 126.4 17.46 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.136 -0.484 . . . . 70.41 110.892 -179.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 179.76 100.55 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.097 -0.501 . . . . 74.2 110.833 -179.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.9 mp 54.45 23.02 4.19 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.063 -0.517 . . . . 70.34 110.912 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -50.89 160.59 0.78 Allowed Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 121.672 0.749 . . . . 71.24 110.913 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.422 ' HG3' ' HA2' ' A' ' 163' ' ' GLY . 54.0 Cg_endo -69.68 -174.85 0.97 Allowed 'Trans proline' 0 C--N 1.341 0.156 0 C-N-CA 122.74 2.293 . . . . 73.34 112.311 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -78.59 118.35 20.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.239 -0.437 . . . . 74.43 110.851 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 6.1 m 64.73 148.22 0.11 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.741 0.781 . . . . 70.4 110.799 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 -50.64 0.44 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.723 2.282 . . . . 71.11 112.313 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.724 ' HD2' HD13 ' A' ' 237' ' ' LEU . 2.7 mtpt -96.77 164.72 12.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.167 -0.47 . . . . 64.45 110.932 179.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . 0.699 ' CE3' HG21 ' A' ' 89' ' ' VAL . 40.8 m0 -46.42 110.5 0.28 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.227 -0.442 . . . . 73.31 110.914 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 15.2 t -115.1 1.26 13.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.248 -0.433 . . . . 65.3 111.169 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.4 172.68 3.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.221 -0.445 . . . . 70.34 110.849 -179.837 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.408 ' O ' ' HB3' ' A' ' 123' ' ' HIS . 0.0 OUTLIER -80.4 -30.43 37.77 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.162 -0.472 . . . . 71.12 110.899 179.88 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.411 HG23 ' CD2' ' A' ' 123' ' ' HIS . 0.3 OUTLIER -159.66 144.83 6.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.449 . . . . 74.14 111.163 179.92 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.699 HG21 ' CE3' ' A' ' 84' ' ' TRP . 12.9 t -127.68 131.92 69.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.252 -0.431 . . . . 72.25 111.15 179.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.525 ' C ' ' HB1' ' A' ' 132' ' ' ALA . 22.9 p -115.44 150.51 36.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.222 -0.444 . . . . 71.01 111.165 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 5.7 p90 -130.85 146.41 52.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.191 -0.459 . . . . 70.51 110.931 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 12.6 ttt180 -149.14 137.0 20.54 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.091 -0.504 . . . . 71.25 110.887 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.48 HD11 ' HA ' ' A' ' 106' ' ' ASP . 11.7 mm -75.02 135.25 27.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.153 -0.476 . . . . 72.4 111.157 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.433 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 18.4 t -90.19 -40.51 12.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.189 -0.46 . . . . 60.2 111.105 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 36.2 t -153.94 169.48 23.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.225 -0.443 . . . . 64.24 110.88 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 14.7 p90 -133.07 155.11 49.82 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.111 -0.495 . . . . 72.25 110.954 -179.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.9 t -99.43 141.91 31.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.165 -0.471 . . . . 64.11 111.16 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 7.7 ptp85 -52.01 -19.98 2.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.215 -0.448 . . . . 72.14 110.826 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . 0.408 ' OD2' HD12 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -70.9 -34.77 71.88 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.261 -0.427 . . . . 74.13 110.808 -179.964 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.645 HD22 HG21 ' A' ' 104' ' ' THR . 6.5 mt -136.08 141.14 35.28 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.628 0.728 . . . . 72.52 110.888 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . 0.589 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.8 Cg_endo -69.78 151.0 68.84 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.717 2.278 . . . . 73.11 112.316 179.879 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 2.3 t-160 -53.52 -25.38 16.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.222 -0.445 . . . . 74.11 110.864 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.589 HG22 ' HB2' ' A' ' 101' ' ' PRO . 15.1 tt -77.43 -41.16 29.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.217 -0.447 . . . . 74.02 111.12 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . 0.793 ' O ' HD22 ' A' ' 108' ' ' LEU . 6.6 m -69.32 -39.05 78.44 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.224 -0.444 . . . . 52.11 111.206 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.8 ' O ' HG13 ' A' ' 109' ' ' VAL . 71.7 t -71.21 -45.5 70.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.157 -0.474 . . . . 71.51 111.112 179.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.614 ' O ' HG22 ' A' ' 109' ' ' VAL . 53.6 t0 -63.32 -39.86 95.74 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.196 -0.457 . . . . 63.44 110.854 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . 0.497 ' HG3' ' N ' ' A' ' 108' ' ' LEU . 0.1 OUTLIER -70.15 -33.57 71.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.232 -0.44 . . . . 75.02 110.891 -179.865 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.793 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -65.17 -48.47 73.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.133 -0.485 . . . . 71.04 110.887 -179.957 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.8 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.2 m -55.15 -42.49 65.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.226 -0.443 . . . . 72.31 111.144 179.842 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.484 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 30.9 t -70.15 -34.71 73.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.13 -0.487 . . . . 72.14 110.869 -179.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.462 ' CG ' HD21 ' A' ' 189' ' ' LEU . 0.3 OUTLIER -62.74 -33.43 75.11 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.124 -0.489 . . . . 74.35 110.895 179.93 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -93.51 -42.08 9.43 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.228 -0.442 . . . . 74.32 111.113 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.732 ' CD1' HD12 ' A' ' 196' ' ' LEU . 0.4 OUTLIER -66.1 -34.14 77.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.243 -0.435 . . . . 72.0 110.958 179.984 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . 0.4 ' CB ' ' O ' ' A' ' 110' ' ' SER . 22.2 t30 -68.6 -35.42 77.32 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.148 -0.478 . . . . 72.34 110.862 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . 0.417 ' O ' ' HG2' ' A' ' 119' ' ' GLU . 0.0 OUTLIER -65.19 -34.14 77.67 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.236 -0.438 . . . . 54.12 110.882 179.923 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 14.6 m95 -67.01 -45.37 77.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.193 -0.458 . . . . 75.23 110.876 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . 0.413 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -67.96 -36.5 86.41 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.73 -0.747 . . . . 73.32 112.49 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.26 -17.41 53.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.767 0.317 . . . . 72.42 110.948 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.773 ' HB3' HG23 ' A' ' 231' ' ' ILE . 9.7 mm-40 -99.99 13.46 33.89 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.247 -0.433 . . . . 75.24 110.898 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 1.013 HD12 HD12 ' A' ' 122' ' ' LEU . 7.7 pt -149.28 143.69 17.18 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.521 0.677 . . . . 71.34 111.166 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 26.0 0.18 Allowed 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.625 2.216 . . . . 72.21 112.355 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 1.013 HD12 HD12 ' A' ' 120' ' ' ILE . 12.5 mt -78.99 -161.19 0.28 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 73.22 110.903 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.411 ' CD2' HG23 ' A' ' 88' ' ' VAL . 3.3 t60 -150.63 121.06 7.37 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.148 -0.478 . . . . 74.12 110.865 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 9.2 m-30 -110.61 147.47 34.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.22 -0.445 . . . . 75.54 110.925 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.424 ' O ' HG22 ' A' ' 90' ' ' THR . 0.0 OUTLIER -131.14 142.07 50.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.455 . . . . 75.14 110.923 -179.946 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.37 160.09 25.51 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.234 -0.439 . . . . 72.22 110.929 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . 0.733 HG11 ' HB2' ' A' ' 132' ' ' ALA . 17.8 m -103.29 126.57 57.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.258 -0.428 . . . . 50.13 111.062 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.595 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -146.9 -11.19 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.138 -0.483 . . . . 74.43 111.066 179.966 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' TRP . . . . . 0.595 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -156.78 109.05 2.49 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.203 -0.453 . . . . 71.25 110.95 179.993 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 103.04 -164.93 15.89 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.79 -0.719 . . . . 62.11 112.541 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.97 155.44 18.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.798 0.332 . . . . 63.25 111.122 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . 0.733 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -112.46 165.55 12.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.242 -0.436 . . . . 51.34 111.093 179.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -76.03 -40.99 52.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.206 -0.452 . . . . 75.41 110.857 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . 0.492 HG23 ' O ' ' A' ' 168' ' ' GLY . 3.1 mm -93.93 107.65 19.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.168 -0.469 . . . . 70.51 111.164 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . 0.433 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 8.1 mmm -99.58 121.55 41.36 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.207 -0.451 . . . . 72.43 110.897 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -106.96 97.15 5.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.252 -0.431 . . . . 70.04 111.125 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -129.85 168.1 21.38 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.728 -0.749 . . . . 63.34 112.466 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' PHE . . . . . 0.591 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 44.4 m-85 -105.25 143.46 33.39 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.808 0.337 . . . . 74.01 110.911 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.591 ' HB2' ' O ' ' A' ' 138' ' ' PHE . . . 168.28 166.27 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.132 -0.486 . . . . 71.21 111.044 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.415 ' HB2' ' HB3' ' A' ' 149' ' ' PHE . 1.5 ptp180 -107.5 174.33 5.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.22 -0.445 . . . . 62.21 110.846 -179.894 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . 0.562 ' H ' ' HA ' ' A' ' 149' ' ' PHE . . . -54.4 -17.55 8.49 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.785 -0.721 . . . . 74.24 112.463 -179.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . 0.558 ' HB2' ' HD2' ' A' ' 149' ' ' PHE . . . -89.17 13.26 13.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.899 0.381 . . . . 75.03 111.115 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . 0.433 ' HB3' ' HB1' ' A' ' 139' ' ' ALA . 6.4 p80 -79.71 0.19 31.53 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.217 -0.447 . . . . 71.11 110.858 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 105.49 51.6 0.85 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.725 -0.75 . . . . 45.51 112.447 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -165.76 175.56 8.67 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.788 0.328 . . . . 72.14 110.898 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.93 177.11 0.82 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 51.25 110.9 -179.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 64.69 119.31 0.02 OUTLIER Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.71 0.767 . . . . 73.4 110.936 -179.861 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.72 151.3 69.27 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 122.676 2.251 . . . . 74.53 112.38 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 149' ' ' PHE . . . . . 0.562 ' HA ' ' H ' ' A' ' 141' ' ' GLY . 2.0 p90 -53.72 -32.89 53.73 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.246 -0.434 . . . . 63.52 110.894 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . 0.519 ' CG ' ' O ' ' A' ' 149' ' ' PHE . 2.8 p30 49.99 15.87 0.2 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.123 -0.49 . . . . 63.11 110.815 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . 0.421 ' C ' ' O ' ' A' ' 150' ' ' ASP . . . 36.72 -153.16 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.723 -0.751 . . . . 71.41 112.457 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 143.58 51.42 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.624 2.216 . . . . 75.11 112.354 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . 0.445 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 105.11 -132.53 11.14 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.753 -0.737 . . . . 70.32 112.559 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 154' ' ' ASN . . . . . 0.445 ' C ' ' O ' ' A' ' 153' ' ' GLY . 2.1 p30 -34.67 143.39 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.96 0.409 . . . . 73.25 110.8 -179.889 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 155' ' ' THR . . . . . 0.504 HG22 ' CA ' ' A' ' 68' ' ' GLY . 0.2 OUTLIER 67.69 109.58 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.114 -0.494 . . . . 44.41 111.148 -179.991 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . 1.028 HD21 HG21 ' A' ' 186' ' ' ILE . 0.8 OUTLIER -88.56 -55.41 3.73 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.253 -0.43 . . . . 75.02 110.928 179.962 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . 0.59 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -159.87 148.75 17.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.152 -0.476 . . . . 71.42 111.038 179.81 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 27.3 p-80 -108.25 125.68 51.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.136 -0.484 . . . . 72.02 110.89 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -110.34 166.53 10.91 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.215 -0.448 . . . . 74.42 111.106 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 21.2 m-30 -115.7 147.32 41.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.257 -0.429 . . . . 75.31 110.887 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . 0.706 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -79.99 164.28 53.62 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.608 0.718 . . . . 61.04 111.056 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 162' ' ' PRO . . . . . 0.706 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.3 Cg_endo -69.81 71.44 1.54 Allowed 'Trans proline' 0 N--CA 1.465 -0.154 0 C-N-CA 122.742 2.295 . . . . 74.44 112.306 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 163' ' ' GLY . . . . . 0.422 ' HA2' ' HG3' ' A' ' 79' ' ' PRO . . . -127.44 100.31 0.54 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.763 -0.732 . . . . 61.41 112.518 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 66.9 172.35 0.25 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.85 0.357 . . . . 73.1 111.095 -179.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -54.35 -37.13 59.13 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.753 -0.737 . . . . 74.03 112.466 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 166' ' ' LEU . . . . . 0.657 HD23 ' O ' ' A' ' 166' ' ' LEU . 4.0 tt -71.26 -19.64 62.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.792 0.33 . . . . 65.12 110.945 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -93.57 144.64 17.21 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.757 -0.735 . . . . 43.43 112.496 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 168' ' ' GLY . . . . . 0.492 ' O ' HG23 ' A' ' 134' ' ' ILE . . . 102.75 13.04 30.85 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.778 -0.725 . . . . 74.31 112.5 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 29.4 m-20 -82.62 167.62 18.11 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.856 0.36 . . . . 63.41 110.86 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -125.75 130.68 51.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.208 -0.451 . . . . 74.21 111.114 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 171' ' ' HIS . . . . . 0.576 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 23.1 m170 -130.66 132.05 45.21 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.286 -0.415 . . . . 72.53 110.887 179.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -115.8 139.41 50.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 71.44 110.859 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 48.3 t0 -71.31 99.77 2.01 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.121 -0.49 . . . . 74.11 110.854 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 1.6 pp20? -57.21 -16.99 9.42 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.231 -0.441 . . . . 72.25 110.913 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -76.36 -16.21 59.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.17 -0.468 . . . . 73.32 110.887 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 23.6 mm-40 -84.34 -174.62 5.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.2 -0.455 . . . . 63.2 110.903 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 12.2 mtt85 -116.49 116.26 27.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.189 -0.46 . . . . 63.14 110.828 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 178' ' ' TRP . . . . . 0.405 ' CE3' ' HB ' ' A' ' 186' ' ' ILE . 13.0 m95 -116.95 146.29 43.08 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.135 -0.484 . . . . 72.31 110.854 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 179' ' ' THR . . . . . 0.576 HG21 ' HB3' ' A' ' 182' ' ' SER . 7.4 t -178.93 163.8 1.41 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.25 -0.432 . . . . 74.13 111.14 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -123.49 -68.11 0.89 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.45 . . . . 45.33 110.901 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -66.63 -10.83 55.68 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.829 -0.701 . . . . 62.41 112.475 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 182' ' ' SER . . . . . 0.576 ' HB3' HG21 ' A' ' 179' ' ' THR . 0.3 OUTLIER -97.32 -24.43 15.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.911 0.386 . . . . 64.5 110.842 -179.716 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 183' ' ' SER . . . . . 0.455 ' C ' ' O ' ' A' ' 182' ' ' SER . 2.9 p 33.33 60.99 0.45 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.107 -0.497 . . . . 64.12 110.926 -179.754 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 16.5 tp -116.85 -33.57 4.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.114 -0.494 . . . . 74.2 110.921 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -121.58 -137.4 5.22 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.747 -0.739 . . . . 73.01 112.514 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 186' ' ' ILE . . . . . 1.028 HG21 HD21 ' A' ' 156' ' ' LEU . 6.6 mm -79.47 99.92 3.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.827 0.346 . . . . 73.22 111.165 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 27.1 m120 -50.93 121.98 6.8 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.2 -0.454 . . . . 71.31 110.85 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 188' ' ' PHE . . . . . 0.782 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.6 t80 -53.93 -35.7 61.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.136 -0.484 . . . . 75.45 110.886 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . 0.462 HD21 ' CG ' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -67.21 -47.6 70.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.181 -0.463 . . . . 52.02 110.881 -179.958 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 6.2 t80 -69.52 -37.26 77.07 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.165 -0.47 . . . . 74.22 110.944 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 191' ' ' ALA . . . . . 0.563 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -72.65 -35.78 67.84 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.098 -0.501 . . . . 50.03 111.071 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 192' ' ' ALA . . . . . 0.739 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -61.48 -44.59 96.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.247 -0.433 . . . . 52.11 111.107 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 193' ' ' THR . . . . . 0.51 HG21 HG21 ' A' ' 211' ' ' VAL . 17.7 m -58.52 -45.22 89.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.172 -0.467 . . . . 72.43 111.136 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 20.8 t-160 -72.59 -40.11 66.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.181 -0.463 . . . . 71.44 110.838 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -71.02 -47.0 61.16 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.232 -0.44 . . . . 71.01 111.165 179.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 196' ' ' LEU . . . . . 0.739 HD23 ' O ' ' A' ' 192' ' ' ALA . 4.5 mm? -64.88 -38.88 92.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.225 -0.443 . . . . 74.51 110.898 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -62.48 -26.69 68.46 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.673 -0.775 . . . . 52.23 112.483 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 198' ' ' HIS . . . . . 0.516 ' CD2' HG21 ' A' ' 69' ' ' VAL . 4.6 m-70 -65.24 -41.47 94.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.864 0.364 . . . . 75.21 110.93 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . 0.479 ' HG ' ' HZ2' ' A' ' 84' ' ' TRP . 31.9 t -64.57 -22.4 66.96 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.134 -0.485 . . . . 71.13 110.893 -179.782 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 2.4 mt -83.11 -2.55 55.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.059 -0.519 . . . . 64.13 110.865 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 84.09 4.7 88.19 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.715 -0.755 . . . . 50.41 112.501 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 202' ' ' MET . . . . . 0.423 ' CE ' ' HB ' ' A' ' 234' ' ' ILE . 43.8 tpp -65.82 144.61 56.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.836 0.35 . . . . 63.21 110.874 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -106.19 159.09 15.24 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.761 -0.733 . . . . 64.44 112.546 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 27.2 m-70 -58.1 166.12 1.68 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.796 0.332 . . . . 74.32 110.913 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 2.1 t -128.56 149.18 50.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.24 -0.436 . . . . 53.34 110.825 -179.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 1.1 m -88.07 -4.28 58.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.081 -0.509 . . . . 72.22 110.843 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 207' ' ' ASP . . . . . 0.429 ' O ' ' CD1' ' A' ' 213' ' ' TYR . 0.1 OUTLIER -71.27 135.51 84.51 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.59 0.709 . . . . 65.11 110.845 -179.962 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.7 -7.7 21.72 Favored 'Trans proline' 0 C--O 1.231 0.148 0 C-N-CA 122.691 2.26 . . . . 74.53 112.352 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 -127.53 24.27 6.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.258 -0.428 . . . . 63.52 110.89 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 210' ' ' ALA . . . . . 0.445 ' O ' ' HB2' ' A' ' 213' ' ' TYR . . . -87.55 145.76 26.08 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.112 -0.495 . . . . 62.23 111.113 179.831 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 211' ' ' VAL . . . . . 0.51 HG21 HG21 ' A' ' 193' ' ' THR . 0.4 OUTLIER -68.44 -24.94 30.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.144 -0.48 . . . . 62.04 111.146 -179.985 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 1.5 mpp? -95.09 9.7 38.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.464 . . . . 75.22 110.885 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 213' ' ' TYR . . . . . 0.445 ' HB2' ' O ' ' A' ' 210' ' ' ALA . 1.8 t80 -55.06 116.75 12.15 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.689 0.757 . . . . 73.43 110.961 -179.884 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.81 -17.98 37.02 Favored 'Trans proline' 0 C--O 1.232 0.208 0 C-N-CA 122.639 2.226 . . . . 63.01 112.353 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -83.93 2.85 36.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.251 -0.431 . . . . 74.24 111.132 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 1.2 t80 64.1 122.78 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.239 -0.437 . . . . 74.14 110.901 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -54.44 117.14 7.31 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.751 -0.738 . . . . 74.22 112.512 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 8.5 m-20 -63.2 161.73 13.14 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.869 0.366 . . . . 64.22 110.893 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . 73.38 167.44 12.96 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.756 -0.735 . . . . 72.24 112.475 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 220' ' ' ASP . . . . . 0.423 ' HA ' ' HD2' ' A' ' 221' ' ' PRO . 0.5 OUTLIER -107.52 101.47 39.62 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 121.559 0.695 . . . . 41.43 110.822 -179.991 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 221' ' ' PRO . . . . . 0.423 ' HD2' ' HA ' ' A' ' 220' ' ' ASP . 54.5 Cg_endo -69.75 131.87 22.16 Favored 'Trans proline' 0 C--O 1.231 0.149 0 C-N-CA 122.664 2.243 . . . . 73.42 112.371 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -70.46 -39.64 74.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.256 -0.429 . . . . 74.21 110.943 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -126.91 -39.85 1.92 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.158 -0.474 . . . . 60.33 110.894 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 64.57 139.26 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.147 -0.479 . . . . 65.01 110.899 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.87 169.32 18.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.096 -0.502 . . . . 64.24 110.914 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . 0.754 HD13 ' HG3' ' A' ' 119' ' ' GLU . 0.9 OUTLIER -59.83 150.73 27.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.205 -0.452 . . . . 53.44 110.898 179.935 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 227' ' ' SER . . . . . 0.445 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 9.8 t -85.4 159.12 20.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.173 -0.467 . . . . 74.21 110.866 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -64.24 -67.24 0.45 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.163 -0.472 . . . . 74.54 110.926 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -55.12 -25.68 33.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.164 -0.471 . . . . 72.22 110.935 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 230' ' ' ASP . . . . . 0.62 ' OD2' HD23 ' A' ' 226' ' ' LEU . 9.9 t0 -69.09 -48.47 62.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.184 -0.462 . . . . 74.23 110.814 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 231' ' ' ILE . . . . . 0.773 HG23 ' HB3' ' A' ' 119' ' ' GLU . 10.2 mt -68.22 -42.94 85.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.216 -0.447 . . . . 73.41 111.137 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 35.4 pttt -65.14 -32.25 73.85 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.164 -0.471 . . . . 65.42 110.872 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -62.8 -48.89 77.51 Favored Glycine 0 C--N 1.33 0.225 0 C-N-CA 120.704 -0.76 . . . . 63.43 112.449 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 234' ' ' ILE . . . . . 0.423 ' HB ' ' CE ' ' A' ' 202' ' ' MET . 11.4 tt -73.05 -31.95 37.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.782 0.325 . . . . 71.54 111.095 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -67.69 -32.71 73.55 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.225 -0.443 . . . . 70.33 110.873 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 236' ' ' LYS . . . . . 0.45 ' HE3' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.17 -22.01 59.6 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.187 -0.46 . . . . 51.21 110.907 179.964 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 237' ' ' LEU . . . . . 0.724 HD13 ' HD2' ' A' ' 83' ' ' LYS . 5.7 tt -97.62 -28.2 14.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.264 -0.425 . . . . 75.41 110.957 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 238' ' ' TYR . . . . . 0.488 ' CE2' HD11 ' A' ' 122' ' ' LEU . 4.4 m-85 -92.12 -35.67 13.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.145 -0.48 . . . . 51.24 110.964 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -118.26 -121.78 3.12 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.72 -0.752 . . . . 32.22 112.508 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 5.2 tttm -87.17 120.37 28.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.773 0.321 . . . . 75.42 110.874 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 20.2 mtm180 -51.64 168.85 0.07 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.235 -0.439 . . . . 73.34 110.879 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 10.7 t -137.37 -41.55 0.56 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.231 -0.44 . . . . 62.42 110.863 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 2.3 m120 63.5 81.56 0.2 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.126 -0.488 . . . . 72.13 110.876 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 97.7 p -174.79 33.47 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.219 -0.446 . . . . 62.23 110.896 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 3.0 ttp180 -110.26 179.32 4.13 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.092 -0.504 . . . . 70.43 110.851 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 4.9 ttpt -161.88 48.29 0.19 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.191 -0.459 . . . . 72.11 110.889 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.45 . . . . 74.13 110.905 179.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 302' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' -2' ' ' LEU . . . . . . . . . . . . . 2.8 mp . . . . . 0 C--O 1.231 0.123 0 CA-C-O 121.533 0.682 . . . . 73.02 110.939 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' -1' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.74 -48.25 0.76 Allowed 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.644 2.229 . . . . 71.15 112.376 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 2.8 mt 64.28 154.6 0.12 Allowed Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.618 0.723 . . . . 62.13 110.914 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 -170.98 0.43 Allowed 'Trans proline' 0 N--CA 1.466 -0.125 0 C-N-CA 122.676 2.25 . . . . 64.14 112.38 179.85 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 21.3 tt0 -142.25 74.31 1.44 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.231 -0.44 . . . . 60.51 110.94 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -95.13 -23.57 17.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.455 . . . . 74.01 110.894 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.32 -33.91 66.06 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.114 -0.494 . . . . 71.4 111.137 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -56.0 -26.83 49.72 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.728 -0.749 . . . . 60.51 112.461 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -108.95 19.65 29.98 Favored Glycine 0 N--CA 1.453 -0.223 0 C-N-CA 120.734 -0.746 . . . . 54.22 112.449 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -90.16 164.17 14.54 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.797 0.332 . . . . 72.23 110.864 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 69.5 m -91.02 168.63 11.51 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.296 -0.411 . . . . 73.24 110.87 -179.787 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -59.68 -32.02 70.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.174 -0.466 . . . . 50.12 110.868 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.1 pp -60.83 -42.82 98.47 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.124 -0.489 . . . . 72.33 110.926 -179.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -62.08 -43.18 99.38 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.213 -0.449 . . . . 72.14 110.923 179.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 13.0 t-105 -72.98 -31.34 64.47 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.254 -0.43 . . . . 71.22 110.908 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -60.24 -35.27 75.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.301 -0.409 . . . . 72.51 110.869 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.94 -36.63 84.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.151 -0.477 . . . . 61.24 110.905 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.13 -35.85 69.97 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.257 -0.429 . . . . 54.34 111.112 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.612 ' NE2' HD22 ' A' ' 35' ' ' LEU . 0.6 OUTLIER -72.49 -42.95 64.32 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.222 -0.444 . . . . 73.12 110.91 -179.926 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.68 -32.64 74.08 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.201 -0.454 . . . . 72.4 110.938 179.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -70.02 -41.87 73.74 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 75.11 110.933 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.705 HD21 ' HG3' ' A' ' 42' ' ' MET . 6.5 mt -71.64 -32.82 68.37 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.131 -0.486 . . . . 72.51 110.841 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.45 ' HE2' ' HA ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -57.04 -37.53 71.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.217 -0.447 . . . . 74.41 110.885 179.918 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.45 ' HA ' ' HE2' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -85.01 -26.62 26.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.201 -0.454 . . . . 74.05 110.869 179.968 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.423 ' HB2' ' HA ' ' A' ' 19' ' ' LEU . 1.5 m-85 -59.53 -38.6 81.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.147 -0.478 . . . . 74.31 110.852 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.57 ' HE2' HD22 ' A' ' 19' ' ' LEU . 2.4 p90 -120.9 43.5 2.76 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.189 -0.46 . . . . 72.55 110.936 -179.868 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.2 mt 62.1 155.06 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.164 -0.471 . . . . 75.43 110.971 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -76.02 89.31 2.99 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.246 -0.434 . . . . 71.41 110.891 -179.909 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 12.4 t0 -96.33 108.89 21.47 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.117 -0.492 . . . . 74.25 110.802 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.66 -17.99 61.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.197 -0.456 . . . . 62.15 110.882 -179.825 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.88 -12.46 60.71 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.109 -0.496 . . . . 74.51 110.907 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.657 HG23 ' HG3' ' A' ' 38' ' ' LYS . 3.7 m -87.26 8.05 25.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.121 -0.491 . . . . 70.44 111.162 -179.935 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.9 mmtp -51.62 159.57 0.75 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.25 -0.432 . . . . 73.33 110.89 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 63.78 158.89 0.08 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.253 -0.43 . . . . 64.43 110.898 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.76 -27.65 60.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.133 -0.485 . . . . 70.21 111.109 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 10.4 m-20 -53.53 -28.39 31.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.236 -0.438 . . . . 35.31 110.889 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.2 m -84.56 -31.33 24.43 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.151 -0.477 . . . . 74.02 110.878 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.612 HD22 ' NE2' ' A' ' 16' ' ' GLN . 32.5 tp -57.92 -44.29 86.76 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.108 -0.497 . . . . 72.52 110.927 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -57.14 -51.11 70.61 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.127 -0.488 . . . . 73.13 110.858 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.65 -36.33 83.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.172 -0.467 . . . . 63.32 111.153 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.657 ' HG3' HG23 ' A' ' 29' ' ' THR . 0.2 OUTLIER -66.51 -49.07 67.75 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.16 -0.473 . . . . 72.32 110.945 179.945 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.801 HD13 HD23 ' A' ' 54' ' ' LEU . 11.3 mt -54.62 -38.2 66.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.268 -0.424 . . . . 72.11 110.925 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.7 mmmt -59.44 -45.87 90.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.159 -0.473 . . . . 62.43 110.877 179.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.404 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 3.3 pt-20 -69.91 -33.78 72.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.203 -0.453 . . . . 75.11 110.9 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.746 ' HE1' HD11 ' A' ' 61' ' ' ILE . 0.3 OUTLIER -68.47 -46.86 68.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.111 -0.495 . . . . 63.43 110.902 179.959 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.559 ' HB3' HG22 ' A' ' 51' ' ' THR . 1.7 mt-30 -57.66 -40.34 79.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.27 -0.423 . . . . 74.45 110.941 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.0 mmpt? -69.82 -25.7 63.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.255 -0.429 . . . . 71.43 110.877 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -70.08 -36.07 74.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.241 -0.436 . . . . 73.32 110.89 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.628 ' CZ ' HD12 ' A' ' 61' ' ' ILE . 28.2 m-85 -80.49 -27.17 37.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.146 -0.479 . . . . 70.43 110.882 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.434 ' HA2' ' HB2' ' A' ' 206' ' ' SER . . . 102.53 -10.3 56.15 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.716 -0.754 . . . . 64.34 112.479 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.549 HD11 ' CG ' ' A' ' 43' ' ' GLN . 0.8 OUTLIER -65.56 140.52 97.57 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.566 0.698 . . . . 64.11 110.899 -179.927 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.665 ' O ' HG23 ' A' ' 51' ' ' THR . 54.7 Cg_endo -69.73 -54.4 0.22 Allowed 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.662 2.241 . . . . 74.5 112.435 179.79 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.558 HD12 ' CG2' ' A' ' 58' ' ' VAL . 0.8 OUTLIER -50.4 108.25 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.189 -0.46 . . . . 71.22 111.166 179.865 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.665 HG23 ' O ' ' A' ' 49' ' ' PRO . 73.6 p -121.96 159.04 27.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.189 -0.46 . . . . 73.25 111.178 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 82.92 -10.69 56.87 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.79 -0.719 . . . . 64.24 112.439 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.421 ' O ' HG21 ' A' ' 58' ' ' VAL . 30.5 mtp -135.22 161.12 36.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.808 0.337 . . . . 75.23 110.842 -179.909 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.801 HD23 HD13 ' A' ' 39' ' ' LEU . 1.4 pp -160.15 129.42 5.09 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.192 -0.458 . . . . 73.4 110.967 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 p30 172.0 -29.04 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.193 -0.458 . . . . 44.35 110.924 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 2.7 m -97.54 -85.38 0.36 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.188 -0.46 . . . . 75.25 110.806 -179.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.595 ' O ' HG23 ' A' ' 61' ' ' ILE . 18.6 tpt180 -84.46 -39.34 19.05 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.12 -0.491 . . . . 61.22 110.859 -179.927 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.558 ' CG2' HD12 ' A' ' 50' ' ' ILE . 15.8 t -59.01 -43.94 90.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.261 -0.427 . . . . 70.12 111.064 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -74.38 -31.17 27.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.23 -0.441 . . . . 74.43 111.133 179.898 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.77 -33.06 71.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.465 . . . . 73.45 110.872 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.746 HD11 ' HE1' ' A' ' 42' ' ' MET . 0.6 OUTLIER -69.94 -29.68 41.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.137 -0.483 . . . . 74.52 111.128 -179.956 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 10.8 mtt -68.04 -35.17 77.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.178 -0.465 . . . . 74.01 110.888 179.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -86.9 -24.05 24.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.234 -0.439 . . . . 42.22 110.912 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.31 123.26 73.35 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.639 0.733 . . . . 65.34 110.801 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.77 147.2 62.27 Favored 'Trans proline' 0 N--CA 1.465 -0.181 0 C-N-CA 122.693 2.262 . . . . 72.11 112.373 179.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.507 ' O ' HD23 ' A' ' 156' ' ' LEU . 0.2 OUTLIER -150.4 -76.34 0.15 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.245 -0.434 . . . . 71.51 110.88 -179.895 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -144.94 153.94 42.06 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.166 -0.47 . . . . 55.3 110.874 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.53 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -103.97 24.07 30.47 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.736 -0.745 . . . . 64.23 112.501 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.622 HG21 ' CD2' ' A' ' 198' ' ' HIS . 0.2 OUTLIER -104.96 136.71 19.13 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 121.65 0.738 . . . . 74.23 111.063 -179.963 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.584 ' HD2' HG12 ' A' ' 69' ' ' VAL . 53.8 Cg_endo -69.71 162.21 42.92 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.683 2.255 . . . . 63.44 112.333 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -128.59 43.03 3.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.206 -0.452 . . . . 74.45 110.842 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -128.98 129.33 68.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.178 -0.464 . . . . 53.43 111.115 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -131.39 170.6 14.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.125 -0.489 . . . . 73.13 111.111 179.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -162.7 82.26 0.51 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.189 -0.46 . . . . 73.31 110.914 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 59.32 169.91 0.07 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.109 -0.496 . . . . 70.41 110.888 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -71.59 179.41 3.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.067 -0.515 . . . . 74.2 110.897 -179.834 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -144.78 -71.31 0.27 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.15 -0.477 . . . . 70.34 110.906 179.939 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . 0.631 ' H ' ' HD2' ' A' ' 79' ' ' PRO . 2.7 m-85 -115.05 -66.88 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.633 0.73 . . . . 71.24 110.903 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.631 ' HD2' ' H ' ' A' ' 78' ' ' PHE . 53.4 Cg_endo -69.8 159.05 54.8 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.608 2.205 . . . . 73.34 112.331 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -102.55 136.44 42.38 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.213 -0.449 . . . . 74.43 110.911 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.4 m 65.8 140.26 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.648 0.737 . . . . 70.4 110.835 -179.845 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 -48.82 0.63 Allowed 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.669 2.246 . . . . 71.11 112.306 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.683 ' CD ' HD13 ' A' ' 237' ' ' LEU . 2.3 mttp -77.72 171.4 15.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.239 -0.437 . . . . 64.45 110.922 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . 0.425 ' CD1' ' HA ' ' A' ' 200' ' ' LEU . 75.9 m95 -66.38 134.84 53.39 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.23 -0.441 . . . . 73.31 110.9 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 5.5 t -115.26 1.36 13.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.259 -0.428 . . . . 65.3 111.172 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -74.95 -178.85 3.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.252 -0.431 . . . . 70.34 110.842 -179.881 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 15.2 mttt -103.08 -8.78 20.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.136 -0.484 . . . . 71.12 110.861 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.632 HG23 ' HD2' ' A' ' 123' ' ' HIS . 0.3 OUTLIER -153.54 144.92 14.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.258 -0.428 . . . . 74.14 111.097 179.966 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 97.4 t -123.62 130.34 74.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.171 -0.468 . . . . 72.25 111.118 179.91 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -116.2 156.34 26.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.164 -0.471 . . . . 71.01 111.097 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 4.8 p90 -147.09 146.84 30.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.254 -0.43 . . . . 70.51 110.967 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -151.15 135.56 16.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.1 -0.5 . . . . 71.25 110.832 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.434 HD11 ' HA ' ' A' ' 106' ' ' ASP . 13.7 mm -75.27 131.67 34.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.185 -0.461 . . . . 72.4 111.144 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.407 ' HB ' ' HA3' ' A' ' 137' ' ' GLY . 16.4 t -88.34 -40.21 13.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.462 . . . . 60.2 111.1 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 3.4 t -151.46 169.63 21.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.186 -0.461 . . . . 64.24 110.803 -179.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 11.5 p90 -130.16 154.16 47.8 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.124 -0.489 . . . . 72.25 110.909 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 3.4 t -102.3 141.64 34.8 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.099 -0.5 . . . . 64.11 111.109 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 4.8 mmp_? -52.63 -17.95 1.54 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.187 -0.46 . . . . 72.14 110.937 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.88 -36.87 85.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.156 -0.475 . . . . 74.13 110.862 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.418 HD11 ' HA ' ' A' ' 179' ' ' THR . 1.7 mp -143.13 152.11 57.27 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-O 121.617 0.722 . . . . 72.52 110.932 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . 0.574 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.9 Cg_endo -69.71 151.03 69.27 Favored 'Trans proline' 0 C--O 1.233 0.226 0 C-N-CA 122.694 2.262 . . . . 73.11 112.38 179.866 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 3.3 t-160 -52.96 -26.59 15.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.251 -0.431 . . . . 74.11 110.91 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.574 HG22 ' HB2' ' A' ' 101' ' ' PRO . 0.0 OUTLIER -76.46 -39.23 33.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.178 -0.464 . . . . 74.02 111.078 -179.999 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . 0.632 ' O ' HD22 ' A' ' 108' ' ' LEU . 3.0 m -69.47 -39.67 77.56 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.146 -0.479 . . . . 52.11 111.11 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.781 ' O ' HG13 ' A' ' 109' ' ' VAL . 72.4 t -72.74 -46.37 53.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.302 -0.408 . . . . 71.51 111.114 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.658 ' O ' HG22 ' A' ' 109' ' ' VAL . 59.7 t0 -58.45 -45.53 88.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.17 -0.468 . . . . 63.44 110.845 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 12.2 ptm180 -70.39 -34.08 72.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.222 -0.445 . . . . 75.02 110.797 -179.785 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.632 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -60.87 -48.68 80.69 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.234 -0.439 . . . . 71.04 110.97 -179.999 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.781 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.5 m -55.33 -41.47 61.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.152 -0.476 . . . . 72.31 111.11 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.462 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 47.0 t -70.11 -33.35 71.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.15 -0.477 . . . . 72.14 110.81 -179.775 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.431 ' HB3' HD21 ' A' ' 189' ' ' LEU . 0.4 OUTLIER -61.56 -32.92 73.02 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.165 -0.47 . . . . 74.35 110.864 179.952 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.81 -40.15 9.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.246 -0.434 . . . . 74.32 111.134 179.773 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.82 ' CD1' HD12 ' A' ' 196' ' ' LEU . 0.6 OUTLIER -65.1 -33.4 75.94 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.218 -0.446 . . . . 72.0 110.884 -179.945 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -70.45 -42.63 71.26 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.208 -0.451 . . . . 72.34 110.884 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . 0.482 ' O ' HD11 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -57.5 -34.75 69.4 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.18 -0.464 . . . . 54.12 110.818 179.926 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 14.6 m95 -61.46 -50.12 74.04 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.252 -0.431 . . . . 75.23 110.906 -179.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . 0.599 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -73.08 -27.48 68.41 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.768 -0.73 . . . . 73.32 112.406 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.2 mmpt? -63.22 -15.18 56.23 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.791 0.329 . . . . 72.42 110.928 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.525 ' HG3' HG21 ' A' ' 231' ' ' ILE . 0.4 OUTLIER -107.57 14.08 26.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.189 -0.46 . . . . 75.24 110.862 -179.985 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.994 HD12 HD12 ' A' ' 122' ' ' LEU . 7.3 pt -147.08 155.64 47.06 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 121.668 0.747 . . . . 71.34 111.101 -180.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.76 3.7 2.62 Favored 'Trans proline' 0 C--N 1.342 0.226 0 C-N-CA 122.633 2.222 . . . . 72.21 112.391 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.994 HD12 HD12 ' A' ' 120' ' ' ILE . 4.6 mt -60.59 -155.37 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.232 -0.44 . . . . 73.22 110.981 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.632 ' HD2' HG23 ' A' ' 88' ' ' VAL . 65.9 t60 -167.81 149.0 5.31 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.266 -0.424 . . . . 74.12 110.86 179.87 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . 0.546 ' CD2' HD21 ' A' ' 113' ' ' LEU . 43.9 m-85 -129.41 148.67 51.35 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.223 -0.444 . . . . 75.54 110.841 -179.901 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.421 ' HG2' ' N ' ' A' ' 126' ' ' LYS . 0.4 OUTLIER -126.22 143.19 51.23 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.13 -0.487 . . . . 75.14 110.919 -179.971 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.421 ' N ' ' HG2' ' A' ' 125' ' ' ARG . 0.0 OUTLIER -80.7 140.34 35.65 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.201 -0.454 . . . . 72.22 110.875 -179.999 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . 0.899 HG11 ' HB2' ' A' ' 132' ' ' ALA . 16.6 m -102.85 129.81 53.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.468 . . . . 50.13 111.082 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.467 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -142.31 -22.61 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.156 -0.475 . . . . 74.43 111.127 179.916 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' TRP . . . . . 0.467 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -139.01 109.18 6.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.146 -0.479 . . . . 71.25 110.88 -179.975 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 108.43 -160.73 13.61 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.711 -0.757 . . . . 62.11 112.466 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -102.0 155.56 18.09 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.795 0.331 . . . . 63.25 111.139 -179.862 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . 0.899 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -112.23 165.47 12.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.201 -0.454 . . . . 51.34 111.057 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -71.53 -58.22 3.7 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.176 -0.466 . . . . 75.41 110.842 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . 0.418 HG22 ' CD1' ' A' ' 136' ' ' ILE . 16.8 mm -85.11 107.96 16.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.226 -0.443 . . . . 70.51 111.123 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 8.4 mmm -95.29 121.0 36.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.152 -0.477 . . . . 72.43 110.869 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.418 ' CD1' HG22 ' A' ' 134' ' ' ILE . 0.7 OUTLIER -106.9 97.79 6.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.306 -0.407 . . . . 70.04 111.099 -179.997 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . 0.407 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -129.36 165.96 21.83 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.725 -0.75 . . . . 63.34 112.533 179.867 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' PHE . . . . . 0.557 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 82.4 m-85 -105.27 141.45 36.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.859 0.362 . . . . 74.01 110.893 -179.846 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.557 ' HB2' ' O ' ' A' ' 138' ' ' PHE . . . 170.24 165.84 0.06 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.119 -0.491 . . . . 71.21 111.092 179.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.42 ' HB2' ' HB3' ' A' ' 149' ' ' PHE . 7.2 ptt180 -105.99 174.08 6.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.194 -0.457 . . . . 62.21 110.849 -179.888 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . 0.536 ' H ' ' HA ' ' A' ' 149' ' ' PHE . . . -55.71 -16.76 12.44 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.716 -0.754 . . . . 74.24 112.46 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . 0.618 ' HB2' ' CD2' ' A' ' 149' ' ' PHE . . . -91.84 13.12 19.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.86 0.362 . . . . 75.03 111.117 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . 0.482 ' HB3' ' HB1' ' A' ' 139' ' ' ALA . 4.3 p80 -79.21 -2.07 39.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.199 -0.455 . . . . 71.11 110.86 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 107.92 49.1 0.85 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.751 -0.738 . . . . 45.51 112.523 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -163.59 174.59 11.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.848 0.356 . . . . 72.14 110.802 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 47.1 p -63.9 -179.61 0.42 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.172 -0.467 . . . . 51.25 110.853 -179.781 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 65.34 119.97 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.627 0.727 . . . . 73.4 110.955 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.8 141.41 45.02 Favored 'Trans proline' 0 C--O 1.232 0.186 0 C-N-CA 122.734 2.29 . . . . 74.53 112.328 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 149' ' ' PHE . . . . . 0.618 ' CD2' ' HB2' ' A' ' 142' ' ' ALA . 3.4 p90 -54.23 -40.71 67.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.275 -0.421 . . . . 63.52 110.879 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . 0.482 ' CG ' ' O ' ' A' ' 149' ' ' PHE . 2.8 p30 49.16 19.19 0.28 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.106 -0.497 . . . . 63.11 110.891 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . 0.423 ' C ' ' O ' ' A' ' 150' ' ' ASP . . . 35.97 -147.53 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.785 -0.721 . . . . 71.41 112.495 -179.942 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.68 145.27 57.09 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.721 2.28 . . . . 75.11 112.325 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . 0.456 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 106.45 -138.99 14.67 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.803 -0.713 . . . . 70.32 112.52 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 154' ' ' ASN . . . . . 0.456 ' C ' ' O ' ' A' ' 153' ' ' GLY . 3.7 p30 -33.8 136.05 0.12 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.896 0.379 . . . . 73.25 110.88 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 155' ' ' THR . . . . . 0.417 HG23 ' HA2' ' A' ' 68' ' ' GLY . 0.6 OUTLIER 77.19 115.91 0.06 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.2 -0.455 . . . . 44.41 111.114 -179.964 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . 0.993 HD21 HG21 ' A' ' 186' ' ' ILE . 0.6 OUTLIER -94.53 -53.39 3.92 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.209 -0.45 . . . . 75.02 110.894 179.961 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . 0.558 ' HB1' ' O ' ' A' ' 171' ' ' HIS . . . -163.97 149.32 10.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.178 -0.464 . . . . 71.42 111.069 179.818 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 29.3 p-80 -109.13 123.6 49.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.256 -0.429 . . . . 72.02 110.903 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -110.54 152.6 26.19 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.248 -0.433 . . . . 74.42 111.067 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -108.01 169.85 8.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.191 -0.459 . . . . 75.31 110.862 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . 0.706 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -107.98 164.23 15.23 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-O 121.624 0.726 . . . . 61.04 111.149 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 162' ' ' PRO . . . . . 0.706 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.9 Cg_endo -69.86 90.06 0.53 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.688 2.259 . . . . 74.44 112.315 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 163' ' ' GLY . . . . . 0.415 ' HA2' ' HB3' ' A' ' 79' ' ' PRO . . . -144.43 141.72 10.36 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.779 -0.724 . . . . 61.41 112.514 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 74.3 m 64.79 -81.31 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.82 0.343 . . . . 73.1 111.135 -179.834 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -179.52 -70.19 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.721 -0.752 . . . . 74.03 112.489 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 166' ' ' LEU . . . . . 0.799 HD22 ' C ' ' A' ' 166' ' ' LEU . 0.0 OUTLIER -54.0 -21.57 8.49 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.815 0.341 . . . . 65.12 110.848 -179.9 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . 0.727 ' N ' HD22 ' A' ' 166' ' ' LEU . . . -80.38 -173.84 46.91 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.732 -0.747 . . . . 43.43 112.543 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 72.8 22.26 79.18 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.775 -0.726 . . . . 74.31 112.444 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -95.93 -174.21 3.05 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.798 0.333 . . . . 63.41 110.858 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -124.71 131.42 53.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.128 -0.487 . . . . 74.21 111.064 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 171' ' ' HIS . . . . . 0.558 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 18.8 m170 -125.92 132.37 52.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.206 -0.452 . . . . 72.53 110.882 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 -114.35 140.26 48.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.195 -0.457 . . . . 71.44 110.911 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 57.8 t0 -73.43 101.59 3.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.138 -0.483 . . . . 74.11 110.881 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.34 -16.21 13.51 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.16 -0.473 . . . . 72.25 110.876 -179.892 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -79.11 -16.16 57.1 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.123 -0.49 . . . . 73.32 110.796 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 37.8 mm-40 -83.61 -175.88 6.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.262 -0.427 . . . . 63.2 110.922 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 54.4 mtm180 -111.59 116.86 31.52 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.225 -0.443 . . . . 63.14 110.881 -179.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 52.1 m95 -116.96 139.89 50.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.203 -0.453 . . . . 72.31 110.959 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 179' ' ' THR . . . . . 0.442 HG21 ' HB3' ' A' ' 182' ' ' SER . 12.7 t -178.11 163.5 1.71 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.236 -0.438 . . . . 74.13 111.142 -179.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -125.32 -70.13 0.76 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.29 -0.413 . . . . 45.33 110.946 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -62.83 -13.57 47.67 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.784 -0.722 . . . . 62.41 112.5 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 182' ' ' SER . . . . . 0.442 ' HB3' HG21 ' A' ' 179' ' ' THR . 0.4 OUTLIER -93.58 -24.41 17.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.859 0.361 . . . . 64.5 110.806 -179.677 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 183' ' ' SER . . . . . 0.422 ' C ' ' O ' ' A' ' 182' ' ' SER . 4.5 m 35.67 57.61 0.9 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.127 -0.488 . . . . 64.12 110.824 -179.776 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 184' ' ' LEU . . . . . 0.408 ' O ' HD23 ' A' ' 184' ' ' LEU . 4.2 tt -116.86 -33.62 4.72 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.124 -0.489 . . . . 74.2 110.837 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -117.99 -140.22 6.43 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.809 -0.71 . . . . 73.01 112.528 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 186' ' ' ILE . . . . . 0.993 HG21 HD21 ' A' ' 156' ' ' LEU . 5.5 mm -79.65 98.58 3.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 120.873 0.368 . . . . 73.22 111.149 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -47.09 120.52 3.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.15 -0.477 . . . . 71.31 110.892 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 188' ' ' PHE . . . . . 0.746 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.4 t80 -54.07 -35.41 62.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.137 -0.483 . . . . 75.45 110.902 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . 0.593 HD12 ' CD2' ' A' ' 224' ' ' PHE . 0.2 OUTLIER -67.11 -48.0 69.47 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.077 -0.51 . . . . 52.02 110.946 -179.95 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -70.22 -40.23 74.63 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.152 -0.476 . . . . 74.22 110.906 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 191' ' ' ALA . . . . . 0.67 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -70.62 -35.07 72.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.143 -0.48 . . . . 50.03 111.08 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 192' ' ' ALA . . . . . 0.6 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -56.62 -44.62 81.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.246 -0.433 . . . . 52.11 111.114 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 193' ' ' THR . . . . . 0.504 HG21 ' HE1' ' A' ' 224' ' ' PHE . 0.2 OUTLIER -58.47 -42.37 87.34 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.285 -0.416 . . . . 72.43 111.109 -179.931 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 14.5 t-160 -73.36 -42.06 62.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.263 -0.426 . . . . 71.44 110.755 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -72.09 -48.59 42.91 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.299 -0.409 . . . . 71.01 111.132 179.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 196' ' ' LEU . . . . . 0.82 HD12 ' CD1' ' A' ' 113' ' ' LEU . 4.4 mm? -65.73 -43.45 88.99 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.218 -0.447 . . . . 74.51 110.965 -179.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -57.34 -28.37 59.04 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.68 -0.771 . . . . 52.23 112.527 179.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 198' ' ' HIS . . . . . 0.622 ' CD2' HG21 ' A' ' 69' ' ' VAL . 6.1 m-70 -65.87 -32.84 74.58 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.777 0.322 . . . . 75.21 110.88 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -69.77 -20.84 63.47 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.265 -0.425 . . . . 71.13 110.847 -179.802 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 200' ' ' LEU . . . . . 0.425 ' HA ' ' CD1' ' A' ' 84' ' ' TRP . 0.3 OUTLIER -89.78 5.56 45.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.139 -0.482 . . . . 64.13 110.916 -179.98 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 83.6 -7.52 68.82 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.704 -0.76 . . . . 50.41 112.577 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 202' ' ' MET . . . . . . . . . . . . . 45.4 tpp -55.27 135.24 49.99 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.797 0.332 . . . . 63.21 110.853 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -113.53 158.94 13.97 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.75 -0.738 . . . . 64.44 112.465 -179.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 204' ' ' HIS . . . . . 0.404 ' HA ' ' HG3' ' A' ' 212' ' ' MET . 11.2 m170 -55.15 150.76 10.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.793 0.33 . . . . 74.32 110.86 -179.92 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -117.51 162.57 17.76 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.149 -0.478 . . . . 53.34 110.84 -179.751 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 206' ' ' SER . . . . . 0.434 ' HB2' ' HA2' ' A' ' 47' ' ' GLY . 2.0 p -88.36 -4.0 58.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.089 -0.505 . . . . 72.22 110.879 -179.803 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -70.89 134.89 85.58 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.645 0.736 . . . . 65.11 110.825 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.85 -6.1 17.85 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.631 2.22 . . . . 74.53 112.362 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 -126.65 33.42 4.97 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.217 -0.447 . . . . 63.52 110.902 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 210' ' ' ALA . . . . . 0.454 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.28 145.77 26.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.148 -0.478 . . . . 62.23 111.063 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -73.31 -25.91 21.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.222 -0.445 . . . . 62.04 111.122 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 212' ' ' MET . . . . . 0.404 ' HG3' ' HA ' ' A' ' 204' ' ' HIS . 0.0 OUTLIER -99.68 8.7 44.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.222 -0.444 . . . . 75.22 110.849 179.908 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 213' ' ' TYR . . . . . 0.449 ' CD1' ' HD2' ' A' ' 214' ' ' PRO . 0.3 OUTLIER -55.31 128.13 66.21 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.679 0.752 . . . . 73.43 110.955 -179.927 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 214' ' ' PRO . . . . . 0.449 ' HD2' ' CD1' ' A' ' 213' ' ' TYR . 54.2 Cg_endo -69.72 -18.54 37.13 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.738 2.292 . . . . 63.01 112.417 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 2.2 p -84.38 48.3 1.48 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.153 -0.476 . . . . 74.24 111.146 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -94.96 122.6 37.77 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.235 -0.439 . . . . 74.14 110.959 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . 177.32 -39.59 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.747 -0.739 . . . . 74.22 112.492 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 30.8 m-80 -60.58 -169.17 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.841 0.353 . . . . 64.22 110.915 -179.882 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . -50.93 105.11 0.17 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.784 -0.722 . . . . 72.24 112.478 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 220' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -75.4 153.56 85.89 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.685 0.755 . . . . 41.43 110.819 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.79 151.19 68.82 Favored 'Trans proline' 0 C--N 1.342 0.229 0 C-N-CA 122.655 2.236 . . . . 73.42 112.278 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -81.61 -27.61 34.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 74.21 110.902 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -115.09 -39.41 3.65 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.192 -0.458 . . . . 60.33 110.887 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 224' ' ' PHE . . . . . 0.593 ' CD2' HD12 ' A' ' 189' ' ' LEU . 0.0 OUTLIER 67.28 136.38 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 65.01 110.899 179.979 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.64 159.61 42.15 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.182 -0.463 . . . . 64.24 110.919 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . 0.63 ' HB3' HD11 ' A' ' 231' ' ' ILE . 24.6 mt -60.21 149.12 34.05 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.287 -0.415 . . . . 53.44 110.882 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 227' ' ' SER . . . . . 0.454 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 1.0 OUTLIER -86.78 152.25 22.67 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.23 -0.441 . . . . 74.21 110.9 -179.927 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -65.19 -68.31 0.37 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.171 -0.468 . . . . 74.54 110.925 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -55.38 -24.97 32.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.174 -0.466 . . . . 72.22 110.826 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 4.9 t0 -69.51 -49.24 56.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.176 -0.465 . . . . 74.23 110.895 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 231' ' ' ILE . . . . . 0.63 HD11 ' HB3' ' A' ' 226' ' ' LEU . 9.2 mt -68.56 -42.63 83.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.203 -0.453 . . . . 73.41 111.211 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 232' ' ' LYS . . . . . 0.41 ' HG3' ' N ' ' A' ' 233' ' ' GLY . 0.2 OUTLIER -59.7 -32.08 70.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.084 -0.507 . . . . 65.42 110.915 179.844 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 233' ' ' GLY . . . . . 0.41 ' N ' ' HG3' ' A' ' 232' ' ' LYS . . . -69.02 -47.11 56.36 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.717 -0.754 . . . . 63.43 112.546 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 13.5 tt -72.59 -30.64 34.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.81 0.338 . . . . 71.54 111.147 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -66.82 -24.56 66.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.108 -0.496 . . . . 70.33 110.975 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 236' ' ' LYS . . . . . 0.472 ' HE3' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.16 -23.1 59.2 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.174 -0.466 . . . . 51.21 110.918 179.929 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 237' ' ' LEU . . . . . 0.683 HD13 ' CD ' ' A' ' 83' ' ' LYS . 10.5 tt -97.24 -38.41 9.69 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.202 -0.454 . . . . 75.41 110.926 179.869 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 238' ' ' TYR . . . . . . . . . . . . . 62.7 m-85 -92.35 -2.66 56.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 51.24 110.914 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -150.69 -118.17 0.84 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.734 -0.746 . . . . 32.22 112.431 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -139.91 122.71 16.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.829 0.347 . . . . 75.42 110.869 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -179.66 167.7 1.39 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.172 -0.467 . . . . 73.34 110.904 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 12.7 p -171.04 128.63 0.73 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.165 -0.47 . . . . 62.42 110.781 -179.754 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -178.58 -54.79 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.112 -0.495 . . . . 72.13 110.86 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 1.4 p -173.76 127.04 0.39 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.145 -0.479 . . . . 62.23 110.844 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.67 107.83 14.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.165 -0.47 . . . . 70.43 110.821 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 27.1 tttt 56.78 25.14 9.91 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 72.11 110.903 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.215 -0.448 . . . . 74.13 110.849 179.85 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 302' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' -2' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.128 0 CA-C-O 121.577 0.703 . . . . 73.02 110.924 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -1' ' ' PRO . . . . . 0.816 ' HB2' HD13 ' A' ' 0' ' ' LEU . 53.6 Cg_endo -69.72 -50.1 0.5 Allowed 'Trans proline' 0 C--O 1.232 0.222 0 C-N-CA 122.626 2.217 . . . . 71.15 112.367 179.867 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 0' ' ' LEU . . . . . 0.816 HD13 ' HB2' ' A' ' -1' ' ' PRO . 0.0 OUTLIER -144.4 159.47 51.69 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.635 0.731 . . . . 62.13 110.945 179.937 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.453 ' HD2' ' HB2' ' A' ' 0' ' ' LEU . 53.9 Cg_endo -69.8 134.45 27.94 Favored 'Trans proline' 0 C--N 1.341 0.145 0 C-N-CA 122.707 2.271 . . . . 64.14 112.33 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 34.3 tt0 52.09 87.48 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.24 -0.436 . . . . 60.51 110.85 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 50.4 tt0 -95.11 -47.76 6.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.171 -0.468 . . . . 74.01 110.91 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.685 ' HB3' ' HB3' ' A' ' 55' ' ' ASN . . . -67.43 -34.04 76.4 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.132 -0.486 . . . . 71.4 111.147 179.915 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -57.29 -41.44 92.99 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.782 -0.723 . . . . 60.51 112.48 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -101.44 21.65 41.95 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.647 -0.787 . . . . 54.22 112.437 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -101.64 164.32 11.81 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.791 0.329 . . . . 72.23 110.882 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -52.36 151.57 3.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.453 . . . . 73.24 110.837 -179.777 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 24.9 pt-20 -62.97 -31.71 72.89 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.154 -0.475 . . . . 50.12 110.931 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.02 -37.44 87.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.129 -0.487 . . . . 72.33 110.907 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.59 HE21 ' N ' ' A' ' 12' ' ' TRP . 0.0 OUTLIER -69.63 -42.69 73.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.165 -0.47 . . . . 72.14 110.887 179.942 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.59 ' N ' HE21 ' A' ' 11' ' ' GLN . 19.0 t-105 -73.21 -31.36 64.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.211 -0.449 . . . . 71.22 110.958 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 62.5 mt-10 -73.41 -35.47 65.85 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.214 -0.448 . . . . 72.51 110.886 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -63.0 -40.97 99.39 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.139 -0.482 . . . . 61.24 110.939 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.658 ' HB1' ' HE3' ' A' ' 62' ' ' MET . . . -61.78 -41.86 98.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.192 -0.458 . . . . 54.34 111.057 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -66.06 -43.15 88.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 73.12 110.9 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -71.07 -31.48 67.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.173 -0.467 . . . . 72.4 110.893 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -70.22 -35.8 74.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.149 -0.478 . . . . 75.11 110.917 -179.805 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.645 HD13 ' O ' ' A' ' 19' ' ' LEU . 3.2 tm? -67.21 -26.24 66.51 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.162 -0.472 . . . . 72.51 110.921 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.407 ' HG2' ' N ' ' A' ' 21' ' ' ARG . 6.3 ptmt -69.43 -32.64 71.73 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.145 -0.48 . . . . 74.41 110.895 179.837 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.407 ' N ' ' HG2' ' A' ' 20' ' ' LYS . 5.3 ptp180 -86.75 -27.62 23.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.213 -0.449 . . . . 74.05 110.905 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.95 -24.29 64.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.162 -0.472 . . . . 74.31 110.955 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.55 ' O ' ' HB3' ' A' ' 70' ' ' PRO . 19.2 m-85 -120.46 -76.84 0.58 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.123 -0.489 . . . . 72.55 110.916 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 97.4 mt -150.01 133.9 16.91 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.08 -0.509 . . . . 75.43 110.895 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -84.92 89.37 7.56 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.167 -0.47 . . . . 71.41 110.961 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -125.11 136.26 53.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.097 -0.501 . . . . 74.25 110.827 179.912 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.3 t -79.14 -7.06 57.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.152 -0.476 . . . . 62.15 110.901 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -61.22 -38.76 87.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.138 -0.483 . . . . 74.51 110.891 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.796 HG21 ' HD2' ' A' ' 38' ' ' LYS . 3.1 m -92.29 9.44 33.92 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.17 -0.468 . . . . 70.44 111.099 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 8.3 ttmt -59.33 99.99 0.07 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.213 -0.449 . . . . 73.33 110.884 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -178.28 147.03 0.41 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.192 -0.458 . . . . 64.43 110.894 179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.97 -38.54 61.66 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.241 -0.436 . . . . 70.21 111.135 179.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -72.13 -26.18 62.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.216 -0.447 . . . . 35.31 110.892 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -66.5 -21.01 66.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.199 -0.455 . . . . 74.02 110.925 -179.868 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.436 ' O ' HD13 ' A' ' 39' ' ' LEU . 0.8 OUTLIER -59.99 -37.13 78.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.067 -0.515 . . . . 72.52 110.953 179.914 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -64.25 -51.34 64.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.21 -0.45 . . . . 73.13 110.886 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.82 -47.85 81.63 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.101 -0.5 . . . . 63.32 111.064 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.796 ' HD2' HG21 ' A' ' 29' ' ' THR . 2.4 tttp -60.17 -38.62 83.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.281 -0.418 . . . . 72.32 110.931 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.7 HD21 ' HB2' ' A' ' 54' ' ' LEU . 0.9 OUTLIER -54.6 -36.68 64.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.208 -0.451 . . . . 72.11 110.911 179.902 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.1 ttpp -58.89 -45.72 89.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.183 -0.462 . . . . 62.43 110.914 179.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -69.79 -37.34 76.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.22 -0.446 . . . . 75.11 110.908 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.444 ' CE ' HD11 ' A' ' 61' ' ' ILE . 6.7 ttt -68.6 -40.29 80.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.106 -0.497 . . . . 63.43 110.907 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.753 ' HG2' HD11 ' A' ' 48' ' ' LEU . 27.1 mt-30 -65.94 -42.36 90.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.241 -0.436 . . . . 74.45 110.889 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.0 mmpt? -63.37 -28.47 70.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.171 -0.468 . . . . 71.43 110.876 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 15.0 t80 -69.8 -36.84 76.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.218 -0.447 . . . . 73.32 110.915 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.59 ' CZ ' HD12 ' A' ' 61' ' ' ILE . 10.2 m-85 -81.2 -35.24 31.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.165 -0.471 . . . . 70.43 110.907 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 102.79 -6.11 51.6 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.733 -0.746 . . . . 64.34 112.465 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.753 HD11 ' HG2' ' A' ' 43' ' ' GLN . 0.6 OUTLIER -59.71 143.13 87.3 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.593 0.711 . . . . 64.11 110.962 -179.932 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.66 -53.92 0.25 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.712 2.275 . . . . 74.5 112.358 179.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.71 HD13 ' OG ' ' A' ' 56' ' ' SER . 0.7 OUTLIER -51.58 108.09 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.146 -0.479 . . . . 71.22 111.157 179.939 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -109.61 160.63 16.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.257 -0.429 . . . . 73.25 111.128 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 57.67 18.51 31.61 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.815 -0.707 . . . . 64.24 112.483 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 10.1 mtt -124.76 161.14 27.07 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.753 0.311 . . . . 75.23 110.885 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.7 ' HB2' HD21 ' A' ' 39' ' ' LEU . 20.1 tp -157.87 96.5 1.49 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.186 -0.461 . . . . 73.4 110.855 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.685 ' HB3' ' HB3' ' A' ' 4' ' ' ALA . 0.7 OUTLIER 174.77 -29.06 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.192 -0.458 . . . . 44.35 110.87 179.892 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . 0.71 ' OG ' HD13 ' A' ' 50' ' ' ILE . 2.5 p -85.08 -99.63 0.06 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.155 -0.475 . . . . 75.25 110.876 -179.83 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -84.84 -30.5 24.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.139 -0.482 . . . . 61.22 110.866 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.44 HG23 HD12 ' A' ' 50' ' ' ILE . 41.9 t -59.33 -43.75 90.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.193 -0.458 . . . . 70.12 111.144 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.414 HG13 ' HA ' ' A' ' 55' ' ' ASN . 2.9 mm -75.05 -31.33 24.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.172 -0.467 . . . . 74.43 111.1 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -66.1 -44.21 85.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.165 -0.471 . . . . 73.45 110.869 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.59 HD12 ' CZ ' ' A' ' 46' ' ' PHE . 35.5 pt -66.29 -29.78 47.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.115 -0.493 . . . . 74.52 111.143 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.658 ' HE3' ' HB1' ' A' ' 15' ' ' ALA . 1.4 mmm -71.18 -33.2 69.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.166 -0.47 . . . . 74.01 110.885 179.836 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -88.09 -25.66 22.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.199 -0.455 . . . . 42.22 110.896 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.01 137.69 37.47 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.573 0.702 . . . . 65.34 110.897 179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -69.79 113.2 3.3 Favored 'Trans proline' 0 C--O 1.232 0.217 0 C-N-CA 122.66 2.24 . . . . 72.11 112.349 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 4.6 ttm180 -106.87 -85.75 0.5 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.296 -0.411 . . . . 71.51 110.873 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -145.86 156.31 43.47 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.19 -0.459 . . . . 55.3 110.848 -179.929 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.562 ' HA2' HG23 ' A' ' 155' ' ' THR . . . -96.63 16.78 60.43 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.739 -0.743 . . . . 64.23 112.468 -179.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.453 HG21 ' CD2' ' A' ' 198' ' ' HIS . 0.0 OUTLIER -111.85 133.15 21.66 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.604 0.716 . . . . 74.23 111.091 -179.927 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.55 ' HB3' ' O ' ' A' ' 23' ' ' TYR . 54.1 Cg_endo -69.7 165.73 29.92 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.66 2.24 . . . . 63.44 112.367 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -120.52 38.51 3.98 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.234 -0.439 . . . . 74.45 110.859 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -139.12 129.59 32.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.167 -0.47 . . . . 53.43 111.102 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -131.03 170.49 14.42 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.145 -0.48 . . . . 73.13 111.06 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -146.69 129.82 16.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.22 -0.446 . . . . 73.31 110.913 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -51.21 167.34 0.08 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.208 -0.451 . . . . 70.41 110.89 -179.872 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.5 m 63.91 158.51 0.08 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.136 -0.484 . . . . 74.2 110.906 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.0 tp 63.36 16.19 9.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.177 -0.465 . . . . 70.34 110.948 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -135.48 160.03 69.38 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-O 121.651 0.739 . . . . 71.24 110.921 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.408 ' HG3' ' HA3' ' A' ' 163' ' ' GLY . 53.5 Cg_endo -69.78 -175.0 1.02 Allowed 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.626 2.217 . . . . 73.34 112.37 -179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 20.9 m120 -98.9 149.0 23.38 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.272 -0.422 . . . . 74.43 110.812 -179.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 4.2 m 65.83 121.26 0.02 OUTLIER Pre-proline 0 C--N 1.33 -0.258 0 CA-C-O 121.628 0.728 . . . . 70.4 110.909 -179.824 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.79 -48.31 0.74 Allowed 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.726 2.284 . . . . 71.11 112.332 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.971 ' HD2' HD23 ' A' ' 237' ' ' LEU . 0.3 OUTLIER -89.61 165.34 14.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.237 -0.438 . . . . 64.45 110.855 179.929 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . 0.493 ' CD1' ' HA ' ' A' ' 200' ' ' LEU . 24.5 m95 -55.86 123.57 14.69 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.153 -0.476 . . . . 73.31 110.91 179.868 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -115.16 1.35 13.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.243 -0.435 . . . . 65.3 111.109 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -69.63 163.25 25.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.198 -0.455 . . . . 70.34 110.849 -179.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.92 -7.21 57.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.153 -0.476 . . . . 71.12 110.837 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.436 HG23 ' CD2' ' A' ' 123' ' ' HIS . 0.3 OUTLIER -172.76 139.21 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.231 -0.441 . . . . 74.14 111.197 179.859 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 13.3 t -122.51 129.59 75.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 72.25 111.091 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.725 HG22 ' HB3' ' A' ' 125' ' ' ARG . 5.0 p -116.99 168.22 10.44 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.169 -0.468 . . . . 71.01 111.144 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.413 ' CD1' ' N ' ' A' ' 91' ' ' TYR . 2.5 p90 -145.26 146.56 31.72 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.259 -0.428 . . . . 70.51 110.909 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.416 ' O ' ' HA ' ' A' ' 135' ' ' MET . 3.4 ttt180 -147.04 132.09 18.23 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.148 -0.478 . . . . 71.25 110.831 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 3.9 mp -74.67 134.97 28.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.155 -0.475 . . . . 72.4 111.113 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.556 HG22 ' CE ' ' A' ' 135' ' ' MET . 11.2 t -93.96 -40.63 11.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.198 -0.456 . . . . 60.2 111.163 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 1.4 t -139.45 164.03 30.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.136 -0.484 . . . . 64.24 110.881 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 11.2 p90 -113.54 152.52 30.12 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.115 -0.493 . . . . 72.25 110.911 -179.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.471 ' OG1' HG21 ' A' ' 105' ' ' VAL . 0.2 OUTLIER -82.74 141.02 32.7 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.126 -0.488 . . . . 64.11 111.119 -179.931 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 4.4 ppt_? -74.15 -7.08 51.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.243 -0.435 . . . . 72.14 110.868 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -96.4 -26.47 15.32 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.181 -0.463 . . . . 74.13 110.82 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.567 HD21 ' HA ' ' A' ' 179' ' ' THR . 0.6 OUTLIER -133.84 153.68 80.06 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-O 121.543 0.687 . . . . 72.52 110.954 -179.928 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . 0.585 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.9 Cg_endo -69.76 150.89 68.82 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.696 2.264 . . . . 73.11 112.322 179.82 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 16.0 t-160 -52.22 -26.21 11.14 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.138 -0.483 . . . . 74.11 110.825 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.585 HG22 ' HB2' ' A' ' 101' ' ' PRO . 13.9 tt -76.8 -39.2 30.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.199 -0.455 . . . . 74.02 111.122 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . 0.67 ' O ' HD22 ' A' ' 108' ' ' LEU . 3.4 m -69.46 -38.56 77.81 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.141 -0.481 . . . . 52.11 111.141 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.744 ' O ' HG13 ' A' ' 109' ' ' VAL . 98.7 t -72.7 -45.08 58.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.275 -0.421 . . . . 71.51 111.152 179.88 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.645 ' O ' HG22 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -64.72 -42.42 95.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.21 -0.45 . . . . 63.44 110.823 179.931 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 13.8 ptm180 -70.14 -34.06 72.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.179 -0.464 . . . . 75.02 110.835 -179.842 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.67 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -61.0 -48.84 79.95 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.221 -0.445 . . . . 71.04 110.961 179.95 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.744 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.4 m -55.78 -41.66 66.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.204 -0.453 . . . . 72.31 111.082 179.867 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.471 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 13.5 t -70.1 -34.29 72.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.19 -0.459 . . . . 72.14 110.845 -179.841 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.463 ' CG ' HD21 ' A' ' 189' ' ' LEU . 0.5 OUTLIER -62.44 -33.53 75.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.164 -0.471 . . . . 74.35 110.928 179.912 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -94.68 -40.2 9.93 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.165 -0.47 . . . . 74.32 111.068 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.714 ' CD1' HD12 ' A' ' 196' ' ' LEU . 0.4 OUTLIER -64.86 -33.11 75.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.224 -0.444 . . . . 72.0 110.926 -179.974 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -65.68 -36.4 83.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.164 -0.471 . . . . 72.34 110.887 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . 0.746 ' O ' HD11 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -64.58 -34.48 78.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.174 -0.466 . . . . 54.12 110.892 179.932 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' TRP . . . . . 0.622 ' O ' ' HG3' ' A' ' 119' ' ' GLU . 6.9 m95 -64.24 -49.48 71.77 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.199 -0.455 . . . . 75.23 110.946 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . 0.567 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -74.79 -19.41 79.92 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.802 -0.713 . . . . 73.32 112.45 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 5.6 mtmt -70.53 -14.01 62.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.739 0.304 . . . . 72.42 110.933 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.638 ' OE1' HG23 ' A' ' 120' ' ' ILE . 2.3 pp20? -109.97 12.45 23.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.243 -0.435 . . . . 75.24 110.877 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 1.082 HD12 HD12 ' A' ' 122' ' ' LEU . 4.7 pt -144.25 142.98 20.69 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.64 0.733 . . . . 71.34 111.133 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 16.57 0.21 Allowed 'Trans proline' 0 C--O 1.233 0.268 0 C-N-CA 122.723 2.282 . . . . 72.21 112.33 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 1.082 HD12 HD12 ' A' ' 120' ' ' ILE . 5.2 mt -62.54 -158.07 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.301 -0.409 . . . . 73.22 110.908 -179.981 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.436 ' CD2' HG23 ' A' ' 88' ' ' VAL . 3.4 t-160 -156.47 121.06 4.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.196 -0.456 . . . . 74.12 110.886 179.796 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 11.6 m-30 -109.88 148.69 31.09 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.205 -0.452 . . . . 75.54 110.905 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.725 ' HB3' HG22 ' A' ' 90' ' ' THR . 0.0 OUTLIER -132.03 142.16 49.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.105 -0.498 . . . . 75.14 110.852 -179.878 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.457 ' HE3' HG13 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -80.03 149.35 30.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.187 -0.46 . . . . 72.22 110.957 179.909 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . 1.025 HG11 ' HB2' ' A' ' 132' ' ' ALA . 26.5 m -103.13 126.14 57.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.195 -0.457 . . . . 50.13 111.087 179.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.608 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -142.98 -9.81 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.204 -0.453 . . . . 74.43 111.157 179.885 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' TRP . . . . . 0.608 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -157.31 108.97 2.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.164 -0.471 . . . . 71.25 110.936 179.96 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 109.1 -159.7 13.93 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.727 -0.749 . . . . 62.11 112.512 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 23.7 p -101.96 156.11 17.74 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.821 0.343 . . . . 63.25 111.153 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . 1.025 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -111.97 165.32 12.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.26 -0.427 . . . . 51.34 111.06 179.873 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . 0.466 ' HB2' HD12 ' A' ' 134' ' ' ILE . 3.0 m-20 -70.03 -65.37 0.73 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.137 -0.483 . . . . 75.41 110.877 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . 0.491 HD12 ' N ' ' A' ' 134' ' ' ILE . 3.9 mp -88.71 106.74 17.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.218 -0.446 . . . . 70.51 111.145 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . 0.556 ' CE ' HG22 ' A' ' 94' ' ' VAL . 0.9 OUTLIER -91.49 128.36 37.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.219 -0.446 . . . . 72.43 110.897 179.838 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.458 ' CD1' HG22 ' A' ' 134' ' ' ILE . 0.5 OUTLIER -106.01 97.6 5.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.302 -0.408 . . . . 70.04 111.1 -179.986 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . 0.4 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -130.18 157.73 22.09 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.727 -0.749 . . . . 63.34 112.479 179.932 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' PHE . . . . . 0.616 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 2.7 m-85 -105.12 147.5 27.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.88 0.371 . . . . 74.01 110.89 -179.844 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.616 ' HB2' ' O ' ' A' ' 138' ' ' PHE . . . 166.81 166.56 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.196 -0.456 . . . . 71.21 111.102 179.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 47.4 mtm180 -104.74 173.06 6.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.205 -0.452 . . . . 62.21 110.867 -179.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -55.02 -20.73 21.4 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.793 -0.718 . . . . 74.24 112.46 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -65.42 -13.57 59.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.818 0.342 . . . . 75.03 111.136 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 2.0 p80 -68.65 -11.13 59.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 71.11 110.917 179.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 116.06 39.41 0.88 Allowed Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.752 -0.737 . . . . 45.51 112.468 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -117.91 142.84 46.89 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.755 0.312 . . . . 72.14 110.838 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 52.8 p -65.28 153.73 40.24 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 51.25 110.883 -179.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 64.88 134.61 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.674 0.75 . . . . 73.4 110.912 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.67 134.62 28.61 Favored 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.7 2.267 . . . . 74.53 112.362 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -69.21 -32.22 71.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.288 -0.414 . . . . 63.52 110.862 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 74.23 -1.45 3.07 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.119 -0.491 . . . . 63.11 110.835 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . 0.663 ' O ' 'CA ' ' A' ' 302' ' ' ' CA' . . . 51.04 -111.12 1.16 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.737 -0.744 . . . . 71.41 112.474 179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.8 139.96 41.36 Favored 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.641 2.227 . . . . 75.11 112.378 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 103.5 -154.38 17.96 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.744 -0.741 . . . . 70.32 112.445 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -41.41 153.17 0.05 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.875 0.369 . . . . 73.25 110.864 -179.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 155' ' ' THR . . . . . 0.562 HG23 ' HA2' ' A' ' 68' ' ' GLY . 0.2 OUTLIER 77.31 108.07 0.08 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.236 -0.438 . . . . 44.41 111.136 -179.993 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . 1.014 HD21 HG21 ' A' ' 186' ' ' ILE . 0.5 OUTLIER -90.83 -53.49 4.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 75.02 110.93 179.953 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . 0.544 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -165.44 148.14 7.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.133 -0.485 . . . . 71.42 111.067 179.809 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 20.0 p-80 -105.75 123.8 48.53 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.156 -0.475 . . . . 72.02 110.903 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -111.33 154.04 25.13 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.274 -0.421 . . . . 74.42 111.094 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 17.7 m-85 -106.8 146.99 30.22 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.202 -0.454 . . . . 75.31 110.845 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . 0.707 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -78.47 164.51 55.67 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 121.631 0.729 . . . . 61.04 111.015 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 162' ' ' PRO . . . . . 0.707 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.3 Cg_endo -69.77 78.12 1.03 Allowed 'Trans proline' 0 C--N 1.343 0.237 0 C-N-CA 122.734 2.29 . . . . 74.44 112.299 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 163' ' ' GLY . . . . . 0.408 ' HA3' ' HG3' ' A' ' 79' ' ' PRO . . . -137.81 114.62 1.11 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.692 -0.766 . . . . 61.41 112.447 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 66.64 168.39 0.23 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.864 0.364 . . . . 73.1 111.143 -179.875 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -64.64 -48.17 75.69 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.695 -0.764 . . . . 74.03 112.474 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 166' ' ' LEU . . . . . 0.461 ' C ' HD23 ' A' ' 166' ' ' LEU . 10.1 tt -62.7 -40.01 95.81 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.846 0.355 . . . . 65.12 110.916 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -79.35 163.16 48.45 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.739 -0.743 . . . . 43.43 112.454 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 89.88 22.72 35.12 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.686 -0.769 . . . . 74.31 112.457 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -91.98 161.65 14.71 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.769 0.319 . . . . 63.41 110.888 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.38 130.46 55.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.231 -0.441 . . . . 74.21 111.076 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 4.8 m170 -126.61 158.46 36.24 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.198 -0.455 . . . . 72.53 110.826 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 58.8 m-85 -140.93 138.84 34.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.151 -0.477 . . . . 71.44 110.868 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 66.7 t0 -70.39 96.77 1.18 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.155 -0.475 . . . . 74.11 110.884 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 2.2 pp20? -57.87 -16.62 12.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.174 -0.467 . . . . 72.25 110.878 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -79.43 -16.4 56.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.145 -0.48 . . . . 73.32 110.814 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 25.1 mm-40 -79.78 -174.91 4.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.262 -0.426 . . . . 63.2 110.839 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 39.6 mtm180 -111.23 111.17 22.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.128 -0.487 . . . . 63.14 110.874 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 12.5 m95 -117.13 145.03 44.06 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.253 -0.43 . . . . 72.31 110.953 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 179' ' ' THR . . . . . 0.57 HG21 ' HB3' ' A' ' 182' ' ' SER . 7.2 t -178.58 163.79 1.55 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.265 -0.425 . . . . 74.13 111.079 -179.914 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -123.09 -68.21 0.9 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 45.33 110.902 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -66.99 -10.83 57.23 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.761 -0.733 . . . . 62.41 112.479 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 182' ' ' SER . . . . . 0.57 ' HB3' HG21 ' A' ' 179' ' ' THR . 0.3 OUTLIER -97.36 -24.44 15.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.763 0.316 . . . . 64.5 110.802 -179.71 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 183' ' ' SER . . . . . 0.449 ' C ' ' O ' ' A' ' 182' ' ' SER . 1.3 m 32.93 61.69 0.38 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.178 -0.465 . . . . 64.12 110.826 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -116.82 -33.66 4.72 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.196 -0.456 . . . . 74.2 110.928 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -121.66 -135.38 4.74 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.743 -0.742 . . . . 73.01 112.486 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 186' ' ' ILE . . . . . 1.014 HG21 HD21 ' A' ' 156' ' ' LEU . 8.5 mm -79.41 97.58 2.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.784 0.326 . . . . 73.22 111.113 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -50.87 123.46 9.18 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.193 -0.458 . . . . 71.31 110.846 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 188' ' ' PHE . . . . . 0.731 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.5 t80 -54.27 -36.55 63.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.144 -0.48 . . . . 75.45 110.821 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . 0.481 HD12 ' CE2' ' A' ' 224' ' ' PHE . 0.0 OUTLIER -67.43 -47.55 69.88 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.189 -0.459 . . . . 52.02 110.922 -179.958 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 40.4 t80 -69.37 -39.28 78.15 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.222 -0.445 . . . . 74.22 110.874 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 191' ' ' ALA . . . . . 0.725 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -71.64 -35.49 70.42 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.122 -0.49 . . . . 50.03 111.091 179.858 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 192' ' ' ALA . . . . . 0.668 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -56.48 -44.91 81.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.214 -0.448 . . . . 52.11 111.103 179.905 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.4 -41.75 90.18 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.2 -0.455 . . . . 72.43 111.193 -179.88 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 18.1 t-160 -72.7 -39.7 66.78 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.195 -0.457 . . . . 71.44 110.843 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -75.02 -48.1 25.77 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.215 -0.448 . . . . 71.01 111.077 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 196' ' ' LEU . . . . . 0.714 HD12 ' CD1' ' A' ' 113' ' ' LEU . 4.5 mm? -62.22 -39.04 91.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.199 -0.455 . . . . 74.51 110.885 -179.892 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -61.24 -26.54 66.18 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.736 -0.745 . . . . 52.23 112.485 179.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 198' ' ' HIS . . . . . 0.453 ' CD2' HG21 ' A' ' 69' ' ' VAL . 6.9 m-70 -70.06 -32.21 70.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.831 0.348 . . . . 75.21 110.856 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -71.72 -21.25 61.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.199 -0.455 . . . . 71.13 110.823 -179.754 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 200' ' ' LEU . . . . . 0.493 ' HA ' ' CD1' ' A' ' 84' ' ' TRP . 0.3 OUTLIER -93.08 -2.44 55.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.154 -0.475 . . . . 64.13 110.974 179.988 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 90.55 -9.5 77.41 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.731 -0.747 . . . . 50.41 112.509 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 202' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.91 129.41 26.8 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.82 0.343 . . . . 63.21 110.858 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -101.02 159.37 18.9 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.734 -0.746 . . . . 64.44 112.451 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 17.5 m-70 -55.93 167.38 0.6 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.774 0.321 . . . . 74.32 110.914 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -129.32 154.14 47.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.242 -0.435 . . . . 53.34 110.873 -179.731 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -87.55 -4.64 58.97 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.178 -0.464 . . . . 72.22 110.821 -179.794 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.72 136.99 82.86 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-O 121.614 0.721 . . . . 65.11 110.927 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 -6.33 18.34 Favored 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.688 2.259 . . . . 74.53 112.375 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -128.05 30.11 5.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.23 -0.441 . . . . 63.52 110.887 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 210' ' ' ALA . . . . . 0.444 ' HA ' ' HB2' ' A' ' 227' ' ' SER . . . -87.17 145.44 26.42 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.204 -0.453 . . . . 62.23 111.122 179.84 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -68.22 -28.53 41.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.256 -0.429 . . . . 62.04 111.167 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 11.0 mtp -97.91 10.52 40.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.134 -0.484 . . . . 75.22 110.897 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 213' ' ' TYR . . . . . 0.412 ' HA ' ' HD2' ' A' ' 214' ' ' PRO . 1.9 t80 -55.56 114.35 7.17 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.638 0.732 . . . . 73.43 110.926 -179.891 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 214' ' ' PRO . . . . . 0.412 ' HD2' ' HA ' ' A' ' 213' ' ' TYR . 53.5 Cg_endo -69.78 -18.36 36.96 Favored 'Trans proline' 0 C--O 1.232 0.209 0 C-N-CA 122.687 2.258 . . . . 63.01 112.316 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 215' ' ' THR . . . . . 0.551 HG23 ' CG2' ' A' ' 61' ' ' ILE . 0.2 OUTLIER -84.24 52.29 2.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.23 -0.441 . . . . 74.24 111.068 -179.893 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -68.8 124.34 23.42 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.26 -0.427 . . . . 74.14 110.906 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . 142.01 68.81 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.781 -0.724 . . . . 74.22 112.454 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -158.6 -53.15 0.06 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.862 0.363 . . . . 64.22 110.881 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . -133.57 158.29 23.17 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.738 -0.744 . . . . 72.24 112.459 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 220' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -120.19 101.42 47.06 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.592 0.71 . . . . 41.43 110.829 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.75 129.1 17.01 Favored 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.734 2.289 . . . . 73.42 112.328 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -81.39 -27.88 34.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.209 -0.451 . . . . 74.21 110.943 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 3.5 p30 -115.15 -39.92 3.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.181 -0.463 . . . . 60.33 110.876 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 224' ' ' PHE . . . . . 0.481 ' CE2' HD12 ' A' ' 189' ' ' LEU . 0.0 OUTLIER 66.45 135.51 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.185 -0.462 . . . . 65.01 110.843 179.947 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -143.4 171.66 13.83 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.21 -0.45 . . . . 64.24 110.905 179.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . 0.746 HD11 ' O ' ' A' ' 115' ' ' MET . 25.5 mt -74.39 148.3 41.34 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.242 -0.435 . . . . 53.44 110.933 179.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 227' ' ' SER . . . . . 0.444 ' HB2' ' HA ' ' A' ' 210' ' ' ALA . 1.3 t -87.47 152.78 21.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.456 . . . . 74.21 110.873 -179.953 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 55.8 mt-30 -65.7 -64.77 0.78 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.137 -0.483 . . . . 74.54 110.928 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -55.85 -26.85 48.8 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 72.22 110.827 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -69.08 -50.06 51.69 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.192 -0.458 . . . . 74.23 110.901 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 231' ' ' ILE . . . . . 0.744 HD11 HD22 ' A' ' 226' ' ' LEU . 2.6 mm -69.93 -43.96 79.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.226 -0.443 . . . . 73.41 111.139 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 3.4 pttt -56.93 -32.69 66.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.168 -0.469 . . . . 65.42 110.847 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 233' ' ' GLY . . . . . 0.441 ' O ' ' HG3' ' A' ' 236' ' ' LYS . . . -65.52 -49.41 60.57 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.723 -0.751 . . . . 63.43 112.484 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 20.5 tt -73.77 -29.95 27.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.712 0.291 . . . . 71.54 111.075 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -62.3 -40.52 96.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.284 -0.417 . . . . 70.33 110.823 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 236' ' ' LYS . . . . . 0.444 ' HE2' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.24 -15.25 61.0 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.252 -0.431 . . . . 51.21 110.895 -179.99 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 237' ' ' LEU . . . . . 0.971 HD23 ' HD2' ' A' ' 83' ' ' LYS . 1.0 OUTLIER -96.57 -35.63 11.02 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.187 -0.46 . . . . 75.41 110.887 179.925 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 238' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -92.41 -35.58 13.6 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.221 -0.445 . . . . 51.24 110.911 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -118.48 -122.24 3.13 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.715 -0.755 . . . . 32.22 112.466 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.56 156.94 46.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.755 0.312 . . . . 75.42 110.894 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 10.5 mtm180 60.07 -169.55 0.15 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.206 -0.452 . . . . 73.34 110.963 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 68.29 12.0 8.58 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.262 -0.426 . . . . 62.42 110.904 -179.787 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 8.4 m120 -49.96 160.88 0.29 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.097 -0.501 . . . . 72.13 110.828 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 78.3 p -142.67 -169.85 3.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.109 -0.496 . . . . 62.23 110.86 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -91.83 -22.72 19.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.131 -0.486 . . . . 70.43 110.85 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 63.28 167.89 0.14 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.153 -0.476 . . . . 72.11 110.886 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.173 -0.467 . . . . 74.13 110.915 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 302' ' ' ' CA' . . . . . 0.663 'CA ' ' O ' ' A' ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' -2' ' ' LEU . . . . . 0.468 HD22 ' CD ' ' A' ' 60' ' ' GLU . 0.3 OUTLIER . . . . . 0 C--O 1.23 0.037 0 CA-C-O 121.649 0.738 . . . . 73.02 110.967 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' -1' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 -11.74 31.46 Favored 'Trans proline' 0 C--O 1.233 0.229 0 C-N-CA 122.686 2.258 . . . . 71.15 112.349 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 7.9 mp -51.93 160.64 1.1 Allowed Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.561 0.696 . . . . 62.13 110.968 179.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.72 -170.91 0.42 Allowed 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.681 2.254 . . . . 64.14 112.369 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -111.59 116.44 30.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.202 -0.454 . . . . 60.51 110.83 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -95.36 -20.24 19.29 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.135 -0.484 . . . . 74.01 110.872 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.623 ' HB3' ' OD1' ' A' ' 55' ' ' ASN . . . -56.35 -33.9 66.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.455 . . . . 71.4 111.168 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -55.7 -32.97 59.06 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.769 -0.729 . . . . 60.51 112.416 -179.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -108.95 21.59 27.12 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.755 -0.736 . . . . 54.22 112.518 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 1.6 ptt? -81.27 164.25 22.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.757 0.313 . . . . 72.23 110.93 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.7 m -86.99 168.74 13.06 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.259 -0.428 . . . . 73.24 110.888 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 60.3 tt0 -54.51 -31.86 56.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.107 -0.497 . . . . 50.12 110.892 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 8.2 mt -62.78 -42.82 99.87 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.145 -0.479 . . . . 72.33 110.908 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -63.19 -44.83 94.27 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.213 -0.449 . . . . 72.14 110.961 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.547 ' CH2' HD23 ' A' ' 54' ' ' LEU . 15.3 t-105 -70.82 -32.84 70.03 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.192 -0.458 . . . . 71.22 110.846 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -68.68 -35.46 77.24 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.282 -0.417 . . . . 72.51 110.939 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -62.94 -37.47 87.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.147 -0.479 . . . . 61.24 110.917 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.401 ' O ' ' HE3' ' A' ' 62' ' ' MET . . . -57.25 -40.15 77.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.209 -0.451 . . . . 54.34 111.087 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.716 ' NE2' HD12 ' A' ' 35' ' ' LEU . 0.6 OUTLIER -70.98 -42.89 69.09 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 73.12 110.955 -179.91 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -67.44 -31.61 71.9 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.182 -0.463 . . . . 72.4 110.865 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 7.4 m-85 -66.53 -41.75 88.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.224 -0.444 . . . . 75.11 110.858 -179.804 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.703 HD13 ' O ' ' A' ' 19' ' ' LEU . 2.1 tm? -71.36 -29.92 65.54 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.106 -0.497 . . . . 72.51 110.908 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.435 ' HE2' ' HA ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -61.44 -39.76 91.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.179 -0.464 . . . . 74.41 110.88 179.85 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.435 ' HA ' ' HE2' ' A' ' 20' ' ' LYS . 6.0 ptp180 -82.56 -27.72 31.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.226 -0.443 . . . . 74.05 110.911 179.957 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.0 m-30 -60.27 -15.87 28.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.189 -0.46 . . . . 74.31 110.897 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.626 ' HB3' HG21 ' A' ' 72' ' ' VAL . 8.4 m-85 -120.52 -72.49 0.69 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.176 -0.465 . . . . 72.55 110.925 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.576 ' HG ' HG23 ' A' ' 72' ' ' VAL . 13.3 mt -160.38 -79.78 0.05 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.133 -0.485 . . . . 75.43 110.965 179.939 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -176.73 89.92 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.136 -0.484 . . . . 71.41 110.922 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -90.28 90.27 8.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.167 -0.47 . . . . 74.25 110.937 179.86 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 26.5 p -85.1 -34.82 22.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.21 -0.45 . . . . 62.15 110.854 -179.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -78.14 -22.13 49.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.113 -0.494 . . . . 74.51 110.883 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -88.14 9.12 23.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.136 -0.484 . . . . 70.44 111.114 -179.878 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.0 mttt -83.02 99.95 10.17 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.245 -0.434 . . . . 73.33 110.931 179.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -177.18 169.28 2.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.222 -0.445 . . . . 64.43 110.883 179.894 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.02 -32.19 66.91 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.145 -0.479 . . . . 70.21 111.166 179.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 15.0 m-80 -84.86 -49.03 8.75 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.469 . . . . 35.31 110.913 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 26.0 p -63.14 -26.45 68.82 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.156 -0.475 . . . . 74.02 110.844 -179.806 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.716 HD12 ' NE2' ' A' ' 16' ' ' GLN . 1.4 tt -58.1 -40.62 81.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.157 -0.474 . . . . 72.52 110.906 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.29 -51.41 63.65 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 73.13 110.817 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -55.3 -42.66 73.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.21 -0.45 . . . . 63.32 111.121 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.475 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.8 OUTLIER -70.38 -48.47 56.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.242 -0.436 . . . . 72.32 110.888 179.937 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.451 HD13 ' HG ' ' A' ' 35' ' ' LEU . 4.3 mp -54.41 -37.29 64.91 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.258 -0.428 . . . . 72.11 110.945 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.6 tmmt? -58.63 -45.55 89.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.181 -0.463 . . . . 62.43 110.898 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.475 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 3.0 pt-20 -60.68 -32.79 71.98 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.225 -0.443 . . . . 75.11 110.849 -179.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 9.3 ttt -68.47 -33.72 74.67 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.143 -0.48 . . . . 63.43 110.909 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.66 ' CD ' HD11 ' A' ' 48' ' ' LEU . 2.2 mm100 -61.63 -39.71 92.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.219 -0.446 . . . . 74.45 110.833 -179.888 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.2 mmpt? -71.6 -33.77 69.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.235 -0.439 . . . . 71.43 110.861 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 33.6 t80 -70.77 -40.26 72.75 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.231 -0.441 . . . . 73.32 110.94 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.861 ' CZ ' HD13 ' A' ' 61' ' ' ILE . 2.8 m-85 -81.76 -35.16 29.93 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.09 -0.505 . . . . 70.43 110.838 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 104.62 -10.08 49.05 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.719 -0.753 . . . . 64.34 112.469 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.686 HD23 ' HB3' ' A' ' 46' ' ' PHE . 0.8 OUTLIER -62.37 134.54 94.9 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.661 0.743 . . . . 64.11 110.897 -179.902 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.462 ' O ' HG23 ' A' ' 51' ' ' THR . 53.6 Cg_endo -69.76 -51.43 0.39 Allowed 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.627 2.218 . . . . 74.5 112.374 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.65 HD11 ' HG2' ' A' ' 57' ' ' ARG . 0.8 OUTLIER -49.61 108.44 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.263 -0.426 . . . . 71.22 111.189 179.895 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.462 HG23 ' O ' ' A' ' 49' ' ' PRO . 77.8 p -97.68 154.1 17.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.183 -0.462 . . . . 73.25 111.133 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 57.81 19.32 35.82 Favored Glycine 0 N--CA 1.453 -0.216 0 C-N-CA 120.724 -0.75 . . . . 64.24 112.445 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 12.8 mmt -101.43 161.12 13.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.811 0.338 . . . . 75.23 110.906 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.547 HD23 ' CH2' ' A' ' 12' ' ' TRP . 28.3 tp -172.21 84.66 0.07 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.215 -0.448 . . . . 73.4 110.884 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.623 ' OD1' ' HB3' ' A' ' 4' ' ' ALA . 1.3 t30 175.46 -28.86 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.134 -0.484 . . . . 44.35 110.88 179.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 30.9 t -89.42 -103.19 0.09 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.132 -0.486 . . . . 75.25 110.88 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.65 ' HG2' HD11 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -84.84 -25.12 28.28 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.182 -0.463 . . . . 61.22 110.956 179.99 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.474 HG22 HD13 ' A' ' 48' ' ' LEU . 46.1 t -64.05 -42.15 94.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.166 -0.47 . . . . 70.12 111.141 179.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.9 mm -75.27 -31.66 24.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.162 -0.472 . . . . 74.43 111.117 179.921 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.468 ' CD ' HD22 ' A' ' -2' ' ' LEU . 29.2 mt-10 -59.69 -44.08 93.79 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.174 -0.466 . . . . 73.45 110.9 179.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.861 HD13 ' CZ ' ' A' ' 46' ' ' PHE . 1.4 pp -63.05 -29.48 47.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.142 -0.481 . . . . 74.52 111.164 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.401 ' HE3' ' O ' ' A' ' 15' ' ' ALA . 11.7 mmt -65.08 -36.73 85.24 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.207 -0.451 . . . . 74.01 110.808 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 15.8 pt20 -91.2 -26.25 19.14 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.306 -0.407 . . . . 42.22 110.877 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.16 125.4 70.3 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.548 0.69 . . . . 65.34 110.911 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.64 151.77 69.82 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.677 2.251 . . . . 72.11 112.351 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.14 -74.55 0.17 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.196 -0.457 . . . . 71.51 110.883 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 26.7 t -130.16 141.56 50.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.217 -0.447 . . . . 55.3 110.935 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.595 ' HA2' HG23 ' A' ' 155' ' ' THR . . . -95.16 16.36 61.47 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.794 -0.717 . . . . 64.23 112.467 -179.909 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.641 HG22 ' HD2' ' A' ' 70' ' ' PRO . 0.7 OUTLIER -125.63 145.4 51.26 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.57 0.7 . . . . 74.23 111.094 -179.927 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.641 ' HD2' HG22 ' A' ' 69' ' ' VAL . 53.6 Cg_endo -69.8 -179.85 3.22 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.727 2.285 . . . . 63.44 112.353 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -133.89 22.11 3.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.251 -0.431 . . . . 74.45 110.899 179.904 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.626 HG21 ' HB3' ' A' ' 23' ' ' TYR . 0.0 OUTLIER -128.63 129.59 68.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.258 -0.428 . . . . 53.43 111.123 -179.978 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -130.8 170.62 14.14 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.139 -0.482 . . . . 73.13 111.068 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -136.47 128.58 29.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.234 -0.439 . . . . 73.31 110.859 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -64.51 122.76 17.53 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.156 -0.475 . . . . 70.41 110.952 -179.868 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 179.99 100.45 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.159 -0.473 . . . . 74.2 110.821 -179.825 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 56.02 21.53 5.12 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.15 -0.477 . . . . 70.34 110.891 179.957 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -75.49 160.13 80.24 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.638 0.732 . . . . 71.24 110.939 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.404 ' HG3' ' CA ' ' A' ' 163' ' ' GLY . 54.2 Cg_endo -69.75 -174.95 1.0 Allowed 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.661 2.241 . . . . 73.34 112.325 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -115.07 154.05 29.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.184 -0.462 . . . . 74.43 110.921 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . 0.409 ' HA ' ' HD2' ' A' ' 82' ' ' PRO . 0.9 OUTLIER 64.44 109.56 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.648 0.737 . . . . 70.4 110.833 -179.864 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.409 ' HD2' ' HA ' ' A' ' 81' ' ' SER . 53.8 Cg_endo -69.75 -49.11 0.59 Allowed 'Trans proline' 0 N--CA 1.465 -0.183 0 C-N-CA 122.696 2.264 . . . . 71.11 112.369 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.829 ' HD2' HD23 ' A' ' 237' ' ' LEU . 0.1 OUTLIER -88.83 150.48 22.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.189 -0.46 . . . . 64.45 110.883 179.925 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . 0.41 ' CD1' ' HA ' ' A' ' 200' ' ' LEU . 70.7 m95 -45.69 109.81 0.21 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.194 -0.457 . . . . 73.31 110.953 179.892 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 15.0 t -95.06 -6.65 41.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.261 -0.427 . . . . 65.3 111.17 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.1 m -65.67 177.94 1.13 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.257 -0.429 . . . . 70.34 110.856 -179.786 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 8.8 mmtp -96.26 -12.0 25.17 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.129 -0.487 . . . . 71.12 110.872 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.479 HG23 ' CD2' ' A' ' 123' ' ' HIS . 0.5 OUTLIER -156.79 142.64 9.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.261 -0.427 . . . . 74.14 111.093 179.924 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 89.9 t -115.69 130.37 70.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.187 -0.461 . . . . 72.25 111.131 179.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.412 HG22 HG13 ' A' ' 127' ' ' VAL . 0.0 OUTLIER -115.7 146.83 41.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.193 -0.458 . . . . 71.01 111.212 179.962 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 4.9 p90 -141.54 146.79 36.78 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.289 -0.414 . . . . 70.51 110.974 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 6.2 ttt180 -150.69 139.0 20.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.155 -0.475 . . . . 71.25 110.862 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.422 HD11 ' HA ' ' A' ' 106' ' ' ASP . 14.2 mm -75.13 125.35 34.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.212 -0.449 . . . . 72.4 111.116 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.657 HG22 ' SD ' ' A' ' 135' ' ' MET . 5.7 t -83.0 -40.58 16.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.139 -0.482 . . . . 60.2 111.175 179.881 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -151.0 169.41 21.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.141 -0.482 . . . . 64.24 110.845 -179.882 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 11.1 p90 -129.72 153.2 48.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.125 -0.489 . . . . 72.25 110.902 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.9 t -101.55 141.68 34.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.121 -0.49 . . . . 64.11 111.122 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.66 -17.78 1.47 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.173 -0.467 . . . . 72.14 110.894 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -65.09 -35.47 81.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.185 -0.462 . . . . 74.13 110.813 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.712 HD21 ' HA ' ' A' ' 179' ' ' THR . 1.8 mp -144.71 152.21 51.93 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 121.616 0.722 . . . . 72.52 110.907 -179.962 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . 0.568 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.3 Cg_endo -69.78 151.11 68.88 Favored 'Trans proline' 0 C--O 1.231 0.143 0 C-N-CA 122.762 2.308 . . . . 73.11 112.321 179.845 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 3.3 t-160 -52.68 -26.71 14.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.222 -0.444 . . . . 74.11 110.815 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.568 HG22 ' HB2' ' A' ' 101' ' ' PRO . 2.5 tp -76.64 -39.53 32.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.276 -0.42 . . . . 74.02 111.106 -179.939 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . 0.684 ' O ' HD22 ' A' ' 108' ' ' LEU . 3.3 m -69.24 -39.9 78.2 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.152 -0.476 . . . . 52.11 111.215 179.913 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.768 ' O ' HG13 ' A' ' 109' ' ' VAL . 70.6 t -72.62 -45.87 56.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.165 -0.47 . . . . 71.51 111.098 179.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.627 ' O ' HG22 ' A' ' 109' ' ' VAL . 59.7 t0 -58.56 -44.98 89.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.453 . . . . 63.44 110.844 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 14.4 ptm180 -70.2 -34.02 72.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.217 -0.447 . . . . 75.02 110.862 -179.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.684 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -61.21 -49.56 76.65 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.133 -0.485 . . . . 71.04 110.901 -179.93 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.768 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.4 m -55.99 -41.99 70.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.144 -0.48 . . . . 72.31 111.142 179.841 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.468 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 37.5 t -70.12 -34.16 72.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.19 -0.459 . . . . 72.14 110.869 -179.865 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.469 ' CG ' HD21 ' A' ' 189' ' ' LEU . 0.3 OUTLIER -62.29 -32.86 73.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.12 -0.491 . . . . 74.35 110.923 179.955 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -95.63 -40.98 9.14 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.232 -0.44 . . . . 74.32 111.06 179.828 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.813 ' CD1' HD12 ' A' ' 196' ' ' LEU . 0.5 OUTLIER -65.86 -33.15 75.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.278 -0.419 . . . . 72.0 110.856 -179.922 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 39.8 t30 -69.61 -39.14 77.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 72.34 110.844 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . 0.511 ' O ' HD11 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -62.58 -34.78 77.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.165 -0.471 . . . . 54.12 110.964 179.868 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 7.0 m95 -62.41 -51.85 65.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.152 -0.476 . . . . 75.23 110.946 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . 0.558 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -73.42 -24.06 75.87 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.726 -0.75 . . . . 73.32 112.478 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 24.9 mtmt -67.75 -13.93 62.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.726 0.298 . . . . 72.42 110.883 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.465 ' HG2' HG13 ' A' ' 231' ' ' ILE . 0.4 OUTLIER -107.51 13.93 26.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.278 -0.419 . . . . 75.24 110.824 -179.996 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.98 HD12 HD12 ' A' ' 122' ' ' LEU . 7.5 pt -144.61 155.96 56.57 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.642 0.734 . . . . 71.34 111.141 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.79 4.68 2.06 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.681 2.254 . . . . 72.21 112.344 179.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.98 HD12 HD12 ' A' ' 120' ' ' ILE . 4.9 mt -61.99 -156.36 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 73.22 110.88 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.479 ' CD2' HG23 ' A' ' 88' ' ' VAL . 4.9 t60 -163.12 138.06 6.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.227 -0.442 . . . . 74.12 110.868 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . 0.55 ' CD2' HD21 ' A' ' 113' ' ' LEU . 30.6 m-85 -123.35 141.77 51.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.165 -0.471 . . . . 75.54 110.864 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -121.55 141.54 50.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.141 -0.481 . . . . 75.14 110.838 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.587 ' HE3' HG13 ' A' ' 128' ' ' VAL . 0.1 OUTLIER -80.78 146.48 30.95 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.18 -0.464 . . . . 72.22 110.913 179.94 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . 1.014 HG11 ' HB2' ' A' ' 132' ' ' ALA . 29.6 m -103.12 126.26 57.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.243 -0.435 . . . . 50.13 111.13 179.868 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.587 HG13 ' HE3' ' A' ' 126' ' ' LYS . 0.0 OUTLIER -141.55 -16.8 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.193 -0.458 . . . . 74.43 111.111 179.925 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' TRP . . . . . 0.531 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -147.21 109.1 4.41 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.199 -0.455 . . . . 71.25 110.949 179.955 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.69 -161.46 13.57 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.734 -0.746 . . . . 62.11 112.461 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.85 156.65 17.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.752 0.311 . . . . 63.25 111.176 -179.883 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . 1.014 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -111.22 164.62 12.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.213 -0.449 . . . . 51.34 111.089 179.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.53 -57.75 5.32 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.235 -0.439 . . . . 75.41 110.878 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 20.8 mt -82.57 132.86 30.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.222 -0.444 . . . . 70.51 111.138 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . 0.657 ' SD ' HG22 ' A' ' 94' ' ' VAL . 27.7 mmt -109.31 115.65 30.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.161 -0.472 . . . . 72.43 110.893 179.879 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -106.07 90.51 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.237 -0.438 . . . . 70.04 111.086 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . 0.468 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -129.84 167.96 21.43 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.735 -0.745 . . . . 63.34 112.45 179.905 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' PHE . . . . . 0.461 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 2.0 m-85 -105.39 149.62 25.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.869 0.366 . . . . 74.01 110.898 -179.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.614 ' HB1' ' CB ' ' A' ' 143' ' ' HIS . . . 175.84 167.23 0.39 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.129 -0.487 . . . . 71.21 111.104 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 72.8 mtt180 -104.14 173.78 6.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.217 -0.447 . . . . 62.21 110.853 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -56.59 -15.79 13.53 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.736 -0.745 . . . . 74.24 112.532 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -99.86 14.57 29.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.722 0.296 . . . . 75.03 111.023 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . 0.614 ' CB ' ' HB1' ' A' ' 139' ' ' ALA . 12.0 p80 -68.21 -33.45 74.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.246 -0.434 . . . . 71.11 110.875 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 147.13 47.01 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.808 -0.711 . . . . 45.51 112.475 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -158.49 149.86 20.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.829 0.347 . . . . 72.14 110.859 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . 0.489 ' O ' ' CB ' ' A' ' 147' ' ' TYR . 37.6 m -63.66 98.39 0.18 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.166 -0.47 . . . . 51.25 110.847 -179.738 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 147' ' ' TYR . . . . . 0.489 ' CB ' ' O ' ' A' ' 146' ' ' SER . 0.2 OUTLIER 161.81 119.93 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.622 0.725 . . . . 73.4 110.939 -179.853 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.81 143.83 51.82 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.677 2.251 . . . . 74.53 112.324 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 149' ' ' PHE . . . . . 0.529 ' O ' ' CG ' ' A' ' 150' ' ' ASP . 0.2 OUTLIER -54.03 -22.73 11.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.133 -0.485 . . . . 63.52 110.845 -179.955 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . 0.529 ' CG ' ' O ' ' A' ' 149' ' ' PHE . 2.8 p30 50.12 18.55 0.4 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.227 -0.442 . . . . 63.11 110.818 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 41.17 -159.73 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.703 -0.761 . . . . 71.41 112.495 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 144.51 54.54 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.697 2.265 . . . . 75.11 112.382 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . 0.444 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 105.8 -134.33 12.05 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.699 -0.762 . . . . 70.32 112.535 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 154' ' ' ASN . . . . . 0.444 ' C ' ' O ' ' A' ' 153' ' ' GLY . 4.3 p30 -34.27 133.67 0.22 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.885 0.374 . . . . 73.25 110.888 -179.952 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 155' ' ' THR . . . . . 0.595 HG23 ' HA2' ' A' ' 68' ' ' GLY . 1.3 m 80.25 105.35 0.07 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.186 -0.461 . . . . 44.41 111.147 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . 0.972 HD21 HG21 ' A' ' 186' ' ' ILE . 0.6 OUTLIER -91.7 -55.53 3.44 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.236 -0.438 . . . . 75.02 110.965 179.895 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . 0.585 ' HB1' ' O ' ' A' ' 171' ' ' HIS . . . -158.45 148.4 19.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.186 -0.461 . . . . 71.42 111.161 179.771 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 158' ' ' HIS . . . . . 0.472 ' HB2' HG23 ' A' ' 69' ' ' VAL . 24.2 p-80 -111.24 116.33 30.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.243 -0.435 . . . . 72.02 110.845 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.631 ' O ' HG21 ' A' ' 69' ' ' VAL . . . -110.86 151.46 27.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.228 -0.442 . . . . 74.42 111.114 179.904 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -118.73 161.17 20.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.216 -0.447 . . . . 75.31 110.845 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . 0.728 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -93.12 164.75 20.37 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.598 0.714 . . . . 61.04 111.061 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 162' ' ' PRO . . . . . 0.728 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.6 Cg_endo -69.86 84.43 0.67 Allowed 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.671 2.247 . . . . 74.44 112.323 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 163' ' ' GLY . . . . . 0.404 ' CA ' ' HG3' ' A' ' 79' ' ' PRO . . . -115.21 117.1 3.9 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.718 -0.753 . . . . 61.41 112.507 179.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 2.5 m 72.68 -69.47 0.19 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.852 0.358 . . . . 73.1 111.162 -179.797 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . 179.08 -61.56 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.729 -0.748 . . . . 74.03 112.439 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 166' ' ' LEU . . . . . 0.804 HD22 ' C ' ' A' ' 166' ' ' LEU . 0.0 OUTLIER -53.91 -21.5 7.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.813 0.34 . . . . 65.12 110.898 -179.9 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . 0.717 ' N ' HD22 ' A' ' 166' ' ' LEU . . . -80.45 -171.5 43.68 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.736 -0.745 . . . . 43.43 112.473 179.908 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 72.88 21.11 80.01 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.723 -0.751 . . . . 74.31 112.523 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 76.8 m-20 -93.69 162.3 13.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.847 0.356 . . . . 63.41 110.889 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -113.34 131.35 55.99 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.145 -0.48 . . . . 74.21 111.064 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 171' ' ' HIS . . . . . 0.585 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 25.3 m170 -124.88 137.16 54.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.245 -0.434 . . . . 72.53 110.857 179.962 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 35.7 m-85 -118.73 139.27 51.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.179 -0.464 . . . . 71.44 110.91 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 55.3 t0 -72.24 100.99 2.72 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.16 -0.473 . . . . 74.11 110.857 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 174' ' ' GLU . . . . . 0.415 ' HG2' ' CD1' ' A' ' 138' ' ' PHE . 0.6 OUTLIER -57.86 -16.08 10.58 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.217 -0.447 . . . . 72.25 110.919 -179.879 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -79.32 -16.25 56.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.119 -0.492 . . . . 73.32 110.938 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 36.4 mm-40 -83.24 -179.51 7.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.18 -0.463 . . . . 63.2 110.878 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 1.5 mtt85 -116.26 113.71 23.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.116 -0.493 . . . . 63.14 110.829 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 5.8 m95 -116.64 147.91 41.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.271 -0.422 . . . . 72.31 110.905 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 179' ' ' THR . . . . . 0.712 ' HA ' HD21 ' A' ' 100' ' ' LEU . 9.2 t -178.73 163.56 1.46 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.246 -0.433 . . . . 74.13 111.194 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -121.7 -71.27 0.74 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.201 -0.454 . . . . 45.33 110.864 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -61.0 -14.9 40.67 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.787 -0.72 . . . . 62.41 112.451 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 182' ' ' SER . . . . . 0.611 ' HB3' HG21 ' A' ' 179' ' ' THR . 0.2 OUTLIER -94.89 -24.33 17.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.926 0.394 . . . . 64.5 110.886 -179.717 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 183' ' ' SER . . . . . 0.451 ' C ' ' O ' ' A' ' 182' ' ' SER . 30.8 m 32.78 59.21 0.42 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.144 -0.48 . . . . 64.12 110.821 -179.869 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 1.3 tt -116.73 -33.58 4.77 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.146 -0.479 . . . . 74.2 110.897 179.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -117.94 -137.95 5.88 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.697 -0.763 . . . . 73.01 112.531 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 186' ' ' ILE . . . . . 0.972 HG21 HD21 ' A' ' 156' ' ' LEU . 9.4 mm -79.48 97.58 2.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.859 0.361 . . . . 73.22 111.128 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -48.41 119.92 3.33 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.139 -0.482 . . . . 71.31 110.871 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 188' ' ' PHE . . . . . 0.727 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.5 t80 -54.16 -36.0 62.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.179 -0.464 . . . . 75.45 110.837 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . 0.469 HD21 ' CG ' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -67.55 -47.85 68.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.144 -0.48 . . . . 52.02 110.901 -179.928 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 54.6 t80 -69.5 -39.11 77.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.195 -0.457 . . . . 74.22 110.909 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 191' ' ' ALA . . . . . 0.666 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -72.52 -34.59 67.71 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.129 -0.487 . . . . 50.03 111.165 179.791 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 192' ' ' ALA . . . . . 0.652 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -56.17 -44.73 79.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.207 -0.451 . . . . 52.11 111.118 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 193' ' ' THR . . . . . 0.578 HG21 HG21 ' A' ' 211' ' ' VAL . 0.3 OUTLIER -57.97 -41.32 82.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.193 -0.458 . . . . 72.43 111.184 -179.958 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -73.02 -46.3 52.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.272 -0.422 . . . . 71.44 110.867 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -68.24 -47.71 67.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.187 -0.461 . . . . 71.01 111.141 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 196' ' ' LEU . . . . . 0.813 HD12 ' CD1' ' A' ' 113' ' ' LEU . 4.4 mm? -64.67 -41.86 95.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.152 -0.476 . . . . 74.51 110.95 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -55.07 -30.93 55.57 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.749 -0.738 . . . . 52.23 112.532 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 198' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 -66.97 -33.48 75.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.684 0.278 . . . . 75.21 110.839 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 5.5 t -68.5 -20.4 64.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.231 -0.44 . . . . 71.13 110.9 -179.778 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 200' ' ' LEU . . . . . 0.41 ' HA ' ' CD1' ' A' ' 84' ' ' TRP . 0.3 OUTLIER -90.57 -2.6 57.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.065 -0.516 . . . . 64.13 110.866 -179.968 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 84.27 8.75 83.12 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.796 -0.716 . . . . 50.41 112.519 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 202' ' ' MET . . . . . 0.455 ' HE1' ' HB ' ' A' ' 234' ' ' ILE . 32.9 tpp -67.54 142.13 56.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.829 0.347 . . . . 63.21 110.877 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -104.7 159.16 16.06 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.715 -0.755 . . . . 64.44 112.487 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 13.7 m-70 -58.58 159.35 6.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.795 0.331 . . . . 74.32 110.855 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 205' ' ' SER . . . . . 0.503 ' OG ' ' HB1' ' A' ' 210' ' ' ALA . 0.0 OUTLIER -121.09 150.05 41.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.251 -0.432 . . . . 53.34 110.817 -179.736 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 4.3 p -87.99 -4.2 58.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.157 -0.474 . . . . 72.22 110.846 -179.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.18 138.12 84.48 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.57 0.7 . . . . 65.11 110.879 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.84 -8.13 22.83 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.663 2.242 . . . . 74.53 112.319 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -126.56 29.36 5.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.221 -0.445 . . . . 63.52 110.941 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 210' ' ' ALA . . . . . 0.503 ' HB1' ' OG ' ' A' ' 205' ' ' SER . . . -87.36 145.53 26.28 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.156 -0.474 . . . . 62.23 111.109 179.908 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 211' ' ' VAL . . . . . 0.578 HG21 HG21 ' A' ' 193' ' ' THR . 0.4 OUTLIER -68.1 -28.34 40.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.215 -0.448 . . . . 62.04 111.147 179.954 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 21.0 mmm -96.97 9.89 40.72 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.169 -0.468 . . . . 75.22 110.893 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 213' ' ' TYR . . . . . 0.409 ' HA ' ' HD2' ' A' ' 214' ' ' PRO . 2.0 t80 -55.6 114.99 8.28 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-O 121.718 0.77 . . . . 73.43 110.949 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 214' ' ' PRO . . . . . 0.409 ' HD2' ' HA ' ' A' ' 213' ' ' TYR . 53.2 Cg_endo -69.72 -18.45 37.17 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.675 2.25 . . . . 63.01 112.316 -179.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -84.34 51.54 2.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.225 -0.443 . . . . 74.24 111.128 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -71.99 122.84 21.55 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.279 -0.419 . . . . 74.14 110.894 -179.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . 167.92 -33.22 0.2 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.735 -0.745 . . . . 74.22 112.463 179.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -105.12 127.56 52.96 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.883 0.373 . . . . 64.22 110.951 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . 86.2 125.49 1.75 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.732 -0.747 . . . . 72.24 112.512 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 220' ' ' ASP . . . . . 0.42 ' HA ' ' HD2' ' A' ' 221' ' ' PRO . 0.1 OUTLIER -117.33 101.41 52.86 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.646 0.736 . . . . 41.43 110.879 -179.981 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 221' ' ' PRO . . . . . 0.42 ' HD2' ' HA ' ' A' ' 220' ' ' ASP . 54.2 Cg_endo -69.73 117.56 5.16 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.723 2.282 . . . . 73.42 112.401 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.26 -22.03 42.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.267 -0.424 . . . . 74.21 110.957 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -116.91 -37.75 3.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.444 . . . . 60.33 110.931 -179.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 224' ' ' PHE . . . . . 0.443 ' HE1' HG21 ' A' ' 193' ' ' THR . 0.0 OUTLIER 65.88 129.28 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.167 -0.47 . . . . 65.01 110.858 179.993 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -143.54 161.63 37.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.168 -0.469 . . . . 64.24 110.828 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . 0.661 HD22 HD11 ' A' ' 231' ' ' ILE . 37.5 mt -66.52 148.26 52.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.193 -0.458 . . . . 53.44 110.895 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 227' ' ' SER . . . . . 0.433 ' HB3' ' HA ' ' A' ' 210' ' ' ALA . 0.0 OUTLIER -87.89 152.84 21.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.189 -0.459 . . . . 74.21 110.837 -179.94 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -65.58 -68.65 0.35 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.12 -0.491 . . . . 74.54 110.9 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 229' ' ' ASP . . . . . 0.415 ' O ' ' HG2' ' A' ' 232' ' ' LYS . 0.4 OUTLIER -56.3 -24.7 45.1 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.223 -0.444 . . . . 72.22 110.897 179.965 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 40.4 t0 -68.38 -49.84 57.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 74.23 110.868 180.0 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 231' ' ' ILE . . . . . 0.661 HD11 HD22 ' A' ' 226' ' ' LEU . 2.8 mm -69.82 -43.15 80.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.225 -0.443 . . . . 73.41 111.085 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 232' ' ' LYS . . . . . 0.415 ' HG2' ' O ' ' A' ' 229' ' ' ASP . 7.9 ptmt -57.58 -31.87 66.59 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.191 -0.459 . . . . 65.42 110.916 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -68.83 -45.54 64.09 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.714 -0.755 . . . . 63.43 112.486 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 234' ' ' ILE . . . . . 0.455 ' HB ' ' HE1' ' A' ' 202' ' ' MET . 5.5 tt -72.86 -34.36 46.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.724 0.297 . . . . 71.54 111.223 179.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -66.31 -26.89 67.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.116 -0.493 . . . . 70.33 110.956 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 236' ' ' LYS . . . . . 0.452 ' HE3' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.67 -22.48 58.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.169 -0.468 . . . . 51.21 110.927 179.925 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 237' ' ' LEU . . . . . 0.829 HD23 ' HD2' ' A' ' 83' ' ' LYS . 1.1 tp -97.24 -16.13 20.51 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.166 -0.47 . . . . 75.41 110.908 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 238' ' ' TYR . . . . . 0.649 ' CZ ' HD11 ' A' ' 122' ' ' LEU . 11.6 m-85 -105.39 -35.19 7.59 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.189 -0.459 . . . . 51.24 110.946 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -107.71 -119.71 4.43 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.726 -0.75 . . . . 32.22 112.46 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 9.7 tttm -101.94 128.03 48.53 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.686 0.279 . . . . 75.42 110.922 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -52.03 141.75 17.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.256 -0.429 . . . . 73.34 110.862 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 30.5 p -163.97 27.36 0.08 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.153 -0.476 . . . . 62.42 110.923 -179.799 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -177.15 174.46 1.66 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.143 -0.481 . . . . 72.13 110.888 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -131.79 119.66 21.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.179 -0.464 . . . . 62.23 110.889 -179.842 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 1.5 ttt180 -162.46 126.89 3.16 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.149 -0.478 . . . . 70.43 110.836 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 12.8 mmtp -113.96 82.15 1.65 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.219 -0.446 . . . . 72.11 110.948 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 74.13 110.922 179.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 302' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' -2' ' ' LEU . . . . . 0.493 ' N ' ' HD2' ' A' ' -1' ' ' PRO . 4.4 mp . . . . . 0 C--O 1.231 0.094 0 CA-C-O 121.614 0.721 . . . . 73.02 110.976 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -1' ' ' PRO . . . . . 0.493 ' HD2' ' N ' ' A' ' -2' ' ' LEU . 53.4 Cg_endo -69.79 -170.84 0.42 Allowed 'Trans proline' 0 C--O 1.231 0.161 0 C-N-CA 122.647 2.231 . . . . 71.15 112.287 179.879 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 7.3 mp 59.02 72.71 0.78 Allowed Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.575 0.702 . . . . 62.13 110.889 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 -8.74 24.36 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.72 2.28 . . . . 64.14 112.331 179.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.4 pm0 -94.08 40.28 1.08 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.203 -0.453 . . . . 60.51 110.888 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -95.39 -23.64 17.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.161 -0.472 . . . . 74.01 110.86 -179.92 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.654 ' HB2' ' O ' ' A' ' 55' ' ' ASN . . . -56.4 -34.04 66.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.162 -0.472 . . . . 71.4 111.1 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -55.83 -26.4 47.36 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.756 -0.735 . . . . 60.51 112.524 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -108.96 21.58 27.12 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.715 -0.755 . . . . 54.22 112.443 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 8.9 ptm -81.03 164.24 22.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.795 0.331 . . . . 72.23 110.909 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 12.6 m -114.1 168.71 9.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.253 -0.43 . . . . 73.24 110.866 -179.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -54.41 -32.58 57.59 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.121 -0.49 . . . . 50.12 110.855 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.0 tp -68.44 -38.12 80.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.166 -0.47 . . . . 72.33 110.901 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 66.1 mm-40 -68.13 -44.84 75.18 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.167 -0.469 . . . . 72.14 110.937 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 37.5 t-105 -71.9 -36.98 70.18 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.262 -0.426 . . . . 71.22 110.923 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -72.98 -35.37 66.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.238 -0.437 . . . . 72.51 110.906 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -63.41 -36.78 84.88 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.156 -0.475 . . . . 61.24 110.881 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.618 ' HB1' ' CE ' ' A' ' 62' ' ' MET . . . -62.44 -34.87 77.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.223 -0.444 . . . . 54.34 111.14 179.93 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.651 HE22 HD22 ' A' ' 35' ' ' LEU . 0.7 OUTLIER -66.07 -43.0 88.64 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.155 -0.475 . . . . 73.12 110.95 -179.958 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -76.81 -34.1 57.94 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.152 -0.477 . . . . 72.4 110.884 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -70.7 -35.91 73.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.15 -0.477 . . . . 75.11 110.911 -179.864 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.631 HD13 ' O ' ' A' ' 19' ' ' LEU . 3.2 tm? -68.31 -26.03 65.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.159 -0.473 . . . . 72.51 110.873 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.56 ' HA ' ' CE1' ' A' ' 23' ' ' TYR . 7.0 ptmt -68.87 -37.11 78.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.178 -0.464 . . . . 74.41 110.86 179.899 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.455 ' N ' ' HG2' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -79.4 -21.83 45.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.255 -0.43 . . . . 74.05 110.88 -179.996 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -55.41 -30.39 60.34 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.235 -0.439 . . . . 74.31 110.827 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.56 ' CE1' ' HA ' ' A' ' 20' ' ' LYS . 44.9 p90 -120.76 -51.26 2.15 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.104 -0.498 . . . . 72.55 110.923 -179.823 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.427 HD23 ' HA ' ' A' ' 24' ' ' LEU . 10.0 mt -164.9 121.83 1.54 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.145 -0.48 . . . . 75.43 110.912 -179.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.474 ' HA ' ' HG3' ' A' ' 20' ' ' LYS . 0.4 OUTLIER -61.8 88.78 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.204 -0.453 . . . . 71.41 110.895 -179.971 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -125.5 130.24 51.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.164 -0.471 . . . . 74.25 110.825 179.922 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 13.1 t -82.48 -6.31 59.23 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.168 -0.469 . . . . 62.15 110.812 -179.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.43 -11.67 61.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.202 -0.453 . . . . 74.51 110.905 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.576 HG23 ' HG3' ' A' ' 38' ' ' LYS . 6.7 m -81.25 0.77 35.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.156 -0.475 . . . . 70.44 111.107 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 22.7 mmtt -50.57 165.97 0.09 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.264 -0.426 . . . . 73.33 110.894 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 8.2 m120 65.43 151.3 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.192 -0.458 . . . . 64.43 110.912 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.01 -19.48 60.06 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.142 -0.481 . . . . 70.21 111.093 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -51.72 -45.39 63.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.22 -0.446 . . . . 35.31 110.923 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -86.87 -19.81 28.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.179 -0.464 . . . . 74.02 110.872 -179.884 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.651 HD22 HE22 ' A' ' 16' ' ' GLN . 35.1 tp -57.75 -45.34 86.0 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.104 -0.498 . . . . 72.52 110.891 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -56.76 -50.7 71.49 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.146 -0.479 . . . . 73.13 110.933 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.55 -36.59 83.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.202 -0.454 . . . . 63.32 111.089 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.576 ' HG3' HG23 ' A' ' 29' ' ' THR . 0.0 OUTLIER -69.43 -48.62 60.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.254 -0.43 . . . . 72.32 110.935 179.961 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.746 ' CD1' HD23 ' A' ' 54' ' ' LEU . 10.2 mt -54.42 -38.59 66.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.159 -0.473 . . . . 72.11 110.937 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.0 ttmm -58.75 -46.1 88.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.166 -0.47 . . . . 62.43 110.828 179.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.403 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 1.6 pt-20 -70.11 -33.35 71.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.221 -0.445 . . . . 75.11 110.842 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.707 ' CE ' HD11 ' A' ' 61' ' ' ILE . 4.2 ttt -68.27 -46.43 70.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.222 -0.445 . . . . 63.43 110.861 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.513 ' CB ' HG22 ' A' ' 51' ' ' THR . 1.7 mt-30 -63.96 -41.77 97.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.254 -0.43 . . . . 74.45 110.911 -179.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.445 ' HE3' HG21 ' A' ' 51' ' ' THR . 8.4 mmtt -66.69 -25.44 66.54 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.147 -0.478 . . . . 71.43 110.837 -179.93 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 38.2 t80 -69.66 -37.03 76.55 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.29 -0.414 . . . . 73.32 110.88 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.597 ' CZ ' HD12 ' A' ' 61' ' ' ILE . 11.8 m-85 -81.27 -31.47 33.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.174 -0.466 . . . . 70.43 110.901 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 104.55 -10.1 49.34 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.776 -0.726 . . . . 64.34 112.469 180.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.546 HD23 ' HB3' ' A' ' 46' ' ' PHE . 0.5 OUTLIER -61.62 144.13 93.02 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.612 0.72 . . . . 64.11 110.922 -179.923 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.501 ' O ' HG23 ' A' ' 51' ' ' THR . 53.4 Cg_endo -69.72 -54.66 0.21 Allowed 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.66 2.24 . . . . 74.5 112.307 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.545 HD12 ' CG2' ' A' ' 58' ' ' VAL . 0.8 OUTLIER -51.04 108.26 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.248 -0.433 . . . . 71.22 111.132 179.988 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.513 HG22 ' CB ' ' A' ' 43' ' ' GLN . 40.3 p -123.38 157.41 33.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.214 -0.448 . . . . 73.25 111.129 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 84.06 -10.85 59.49 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.742 -0.742 . . . . 64.24 112.491 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 1.2 mtt -135.16 156.81 48.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.895 0.379 . . . . 75.23 110.874 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.746 HD23 ' CD1' ' A' ' 39' ' ' LEU . 1.9 pp -156.99 129.15 7.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.2 -0.455 . . . . 73.4 110.917 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.654 ' O ' ' HB2' ' A' ' 4' ' ' ALA . 0.5 OUTLIER 173.87 -29.33 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.216 -0.447 . . . . 44.35 110.936 179.874 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 26.1 t -94.16 -89.15 0.23 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.116 -0.493 . . . . 75.25 110.859 -179.871 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.599 ' O ' HG23 ' A' ' 61' ' ' ILE . 7.6 tpt180 -84.76 -35.99 22.05 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.118 -0.492 . . . . 61.22 110.919 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.545 ' CG2' HD12 ' A' ' 50' ' ' ILE . 21.8 t -60.26 -41.73 88.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.132 -0.485 . . . . 70.12 111.132 179.941 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.402 HD13 ' HB2' ' A' ' 62' ' ' MET . 0.2 OUTLIER -74.67 -31.01 25.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.192 -0.458 . . . . 74.43 111.133 179.939 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -59.97 -43.79 94.88 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.128 -0.487 . . . . 73.45 110.921 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.707 HD11 ' CE ' ' A' ' 42' ' ' MET . 0.7 OUTLIER -65.92 -29.78 47.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.148 -0.478 . . . . 74.52 111.167 179.893 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.618 ' CE ' ' HB1' ' A' ' 15' ' ' ALA . 3.9 mmm -70.39 -33.75 71.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.133 -0.485 . . . . 74.01 110.889 179.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -88.08 -25.88 22.82 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.202 -0.454 . . . . 42.22 110.898 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.1 mtmp? -85.04 151.93 58.03 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.553 0.692 . . . . 65.34 110.927 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . 0.545 ' HB2' HD22 ' A' ' 156' ' ' LEU . 53.8 Cg_endo -69.77 143.68 51.57 Favored 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.695 2.264 . . . . 72.11 112.381 179.879 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 25.8 ttp180 -141.36 -85.52 0.18 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.273 -0.421 . . . . 71.51 110.855 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 16.2 p -145.67 143.75 29.99 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.233 -0.439 . . . . 55.3 110.894 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.636 ' HA2' HG23 ' A' ' 155' ' ' THR . . . -89.08 11.87 68.01 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.683 -0.77 . . . . 64.23 112.466 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.493 HG12 ' HD2' ' A' ' 70' ' ' PRO . 0.1 OUTLIER -116.93 141.4 28.25 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.577 0.703 . . . . 74.23 111.139 -179.987 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.493 ' HD2' HG12 ' A' ' 69' ' ' VAL . 53.6 Cg_endo -69.74 178.12 4.87 Favored 'Trans proline' 0 N--CA 1.465 -0.148 0 C-N-CA 122.719 2.28 . . . . 63.44 112.316 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -128.68 42.63 3.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.204 -0.453 . . . . 74.45 110.798 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -153.84 129.94 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.226 -0.443 . . . . 53.43 111.105 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -130.98 170.4 14.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.123 -0.489 . . . . 73.13 111.103 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -178.22 142.9 0.28 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.236 -0.438 . . . . 73.31 110.879 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 63.43 170.17 0.15 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.179 -0.464 . . . . 70.41 110.898 -179.913 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.5 m 65.83 115.52 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.11 -0.495 . . . . 74.2 110.8 -179.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -145.92 34.59 1.01 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.108 -0.496 . . . . 70.34 110.891 179.952 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . 0.497 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 0.6 OUTLIER -52.4 -59.95 7.44 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.632 0.729 . . . . 71.24 110.869 179.866 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.497 ' HD2' ' N ' ' A' ' 78' ' ' PHE . 53.5 Cg_endo -69.81 144.67 54.51 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.724 2.283 . . . . 73.34 112.303 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 16.7 m-80 -79.0 120.76 24.05 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.175 -0.466 . . . . 74.43 111.007 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 4.6 m 65.98 138.76 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.591 0.71 . . . . 70.4 110.873 -179.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 -15.09 36.76 Favored 'Trans proline' 0 C--N 1.341 0.151 0 C-N-CA 122.655 2.236 . . . . 71.11 112.311 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.708 ' HD3' HD22 ' A' ' 237' ' ' LEU . 5.1 mtpt -106.78 155.24 19.91 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.231 -0.441 . . . . 64.45 110.934 179.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . 0.652 ' CE3' HG21 ' A' ' 89' ' ' VAL . 38.4 m0 -50.11 112.33 0.66 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.21 -0.45 . . . . 73.31 110.938 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -115.37 -8.1 12.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.251 -0.432 . . . . 65.3 111.105 -179.894 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -59.57 176.13 0.29 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.23 -0.441 . . . . 70.34 110.84 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.34 -30.78 25.21 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.075 -0.512 . . . . 71.12 110.832 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.411 HG23 ' CD2' ' A' ' 123' ' ' HIS . 0.3 OUTLIER -156.79 144.48 10.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.269 -0.423 . . . . 74.14 111.113 179.865 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.652 HG21 ' CE3' ' A' ' 84' ' ' TRP . 21.7 t -129.33 134.53 63.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.14 -0.482 . . . . 72.25 111.116 179.926 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.461 ' C ' ' HB1' ' A' ' 132' ' ' ALA . 22.0 p -115.66 151.84 34.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.213 -0.449 . . . . 71.01 111.137 -179.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 4.6 p90 -132.2 146.01 51.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.227 -0.442 . . . . 70.51 110.937 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 9.4 ttt180 -146.61 136.5 23.33 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.088 -0.505 . . . . 71.25 110.828 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.419 HD11 ' HA ' ' A' ' 106' ' ' ASP . 10.4 mm -75.87 134.18 29.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.154 -0.475 . . . . 72.4 111.092 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.45 ' HB ' ' HA3' ' A' ' 137' ' ' GLY . 15.1 t -92.29 -40.37 12.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.174 -0.466 . . . . 60.2 111.196 179.776 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -150.41 169.45 21.41 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.16 -0.473 . . . . 64.24 110.848 -179.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 16.7 p90 -132.24 155.25 48.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.201 -0.454 . . . . 72.25 110.926 -179.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 2.9 t -99.72 141.89 31.93 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.076 -0.511 . . . . 64.11 111.126 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.4 -18.02 1.45 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.195 -0.457 . . . . 72.14 110.876 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -65.02 -35.95 82.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.183 -0.462 . . . . 74.13 110.839 -180.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.493 HD23 HG21 ' A' ' 104' ' ' THR . 1.8 mp -144.24 152.45 54.2 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.554 0.693 . . . . 72.52 110.959 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . 0.582 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.2 Cg_endo -69.79 151.07 68.77 Favored 'Trans proline' 0 C--O 1.232 0.216 0 C-N-CA 122.717 2.278 . . . . 73.11 112.32 179.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 -51.07 -26.66 6.67 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.173 -0.467 . . . . 74.11 110.901 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.582 HG22 ' HB2' ' A' ' 101' ' ' PRO . 10.5 tp -76.74 -38.45 30.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.181 -0.463 . . . . 74.02 111.101 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . 0.642 ' O ' HD22 ' A' ' 108' ' ' LEU . 3.2 m -68.86 -39.47 79.85 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.197 -0.456 . . . . 52.11 111.198 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.756 ' O ' HG13 ' A' ' 109' ' ' VAL . 69.9 t -73.0 -45.29 55.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.21 -0.45 . . . . 71.51 111.101 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.662 ' O ' HG22 ' A' ' 109' ' ' VAL . 43.3 t0 -60.39 -44.96 95.16 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.213 -0.449 . . . . 63.44 110.903 179.873 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 11.5 ptm180 -70.15 -33.5 71.88 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.183 -0.462 . . . . 75.02 110.925 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.642 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -60.68 -48.89 79.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.193 -0.458 . . . . 71.04 110.922 -179.984 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.756 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.5 m -55.44 -41.68 63.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.156 -0.475 . . . . 72.31 111.197 179.845 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.465 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 47.7 t -70.11 -33.57 72.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.173 -0.467 . . . . 72.14 110.875 -179.902 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.465 ' HB3' HD21 ' A' ' 189' ' ' LEU . 0.4 OUTLIER -61.96 -33.01 73.5 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.091 -0.504 . . . . 74.35 110.892 179.929 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.29 -40.32 9.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.26 -0.427 . . . . 74.32 111.049 179.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 1.016 HD13 HD12 ' A' ' 196' ' ' LEU . 6.4 tp -65.31 -32.54 74.25 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.29 -0.413 . . . . 72.0 110.884 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -65.37 -38.4 89.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.213 -0.449 . . . . 72.34 110.87 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . 0.641 ' O ' HD11 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -62.24 -34.48 76.58 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.232 -0.44 . . . . 54.12 110.883 179.856 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 7.1 m95 -67.04 -52.41 42.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.223 -0.444 . . . . 75.23 110.863 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -59.65 -37.87 92.93 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.718 -0.753 . . . . 73.32 112.522 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.1 mmpt? -61.34 -17.07 52.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.729 0.3 . . . . 72.42 110.872 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.819 ' HG2' HD13 ' A' ' 226' ' ' LEU . 0.5 OUTLIER -98.99 12.85 34.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.242 -0.436 . . . . 75.24 110.902 179.992 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 1.9 pt -148.28 145.76 21.35 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.711 0.767 . . . . 71.34 111.059 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.84 6.32 1.38 Allowed 'Trans proline' 0 C--N 1.343 0.249 0 C-N-CA 122.678 2.252 . . . . 72.21 112.341 179.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.433 ' HA ' HD23 ' A' ' 122' ' ' LEU . 4.1 mt -62.77 -156.95 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.203 -0.453 . . . . 73.22 110.962 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.411 ' CD2' HG23 ' A' ' 88' ' ' VAL . 4.3 t60 -154.6 123.15 6.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.284 -0.416 . . . . 74.12 110.882 179.882 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 9.2 m-30 -108.23 133.14 52.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.224 -0.444 . . . . 75.54 110.868 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.425 ' O ' HG22 ' A' ' 90' ' ' THR . 0.0 OUTLIER -119.29 141.66 48.78 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.165 -0.47 . . . . 75.14 110.921 -179.915 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.82 160.27 24.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.197 -0.456 . . . . 72.22 110.852 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . 0.731 HG11 ' HB2' ' A' ' 132' ' ' ALA . 18.2 m -103.1 126.61 57.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.185 -0.462 . . . . 50.13 111.102 179.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.583 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -146.96 -13.35 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.157 -0.474 . . . . 74.43 111.138 179.896 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' TRP . . . . . 0.583 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -153.65 109.05 3.2 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.173 -0.467 . . . . 71.25 110.89 179.919 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 102.45 -165.09 16.66 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.804 -0.712 . . . . 62.11 112.541 179.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.99 155.67 18.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.824 0.345 . . . . 63.25 111.093 -179.835 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . 0.731 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -112.37 165.7 11.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.213 -0.449 . . . . 51.34 111.06 179.811 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -76.34 -41.67 47.53 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.19 -0.459 . . . . 75.41 110.885 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . 0.65 HG23 ' O ' ' A' ' 168' ' ' GLY . 3.9 mm -94.76 107.83 19.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.185 -0.461 . . . . 70.51 111.146 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . 0.433 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 9.3 mmm -98.59 122.5 41.87 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.152 -0.476 . . . . 72.43 110.929 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -106.28 95.23 3.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.262 -0.426 . . . . 70.04 111.162 179.99 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . 0.45 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -132.6 165.93 23.63 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.755 -0.736 . . . . 63.34 112.495 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' PHE . . . . . 0.539 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 2.8 m-85 -107.11 147.07 30.49 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.838 0.351 . . . . 74.01 110.872 -179.844 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.539 ' HB2' ' O ' ' A' ' 138' ' ' PHE . . . 170.96 166.35 0.08 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.166 -0.47 . . . . 71.21 111.131 179.894 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 34.8 mtp180 -105.05 173.57 6.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.183 -0.462 . . . . 62.21 110.87 -179.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -53.51 -22.02 15.36 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.742 -0.742 . . . . 74.24 112.455 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -67.48 -10.9 55.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.827 0.346 . . . . 75.03 111.163 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 2.5 p80 -68.81 -11.91 60.94 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 71.11 110.865 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 118.63 39.57 0.71 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.736 -0.745 . . . . 45.51 112.454 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -123.3 141.1 52.33 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.748 0.309 . . . . 72.14 110.872 -179.952 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 3.0 m -64.23 156.03 30.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.219 -0.446 . . . . 51.25 110.902 -179.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 64.93 133.24 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.691 0.758 . . . . 73.4 110.881 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 134.67 28.52 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.712 2.275 . . . . 74.53 112.358 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -66.99 -29.69 69.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.26 -0.427 . . . . 63.52 110.865 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 75.21 -2.8 2.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.118 -0.492 . . . . 63.11 110.94 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . 0.636 ' O ' 'CA ' ' A' ' 302' ' ' ' CA' . . . 57.0 -117.3 9.31 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.718 -0.753 . . . . 71.41 112.475 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 138.9 38.82 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.649 2.233 . . . . 75.11 112.34 -179.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 103.16 -147.9 17.02 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.779 -0.724 . . . . 70.32 112.501 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -39.97 149.04 0.07 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.887 0.375 . . . . 73.25 110.9 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 155' ' ' THR . . . . . 0.636 HG23 ' HA2' ' A' ' 68' ' ' GLY . 0.9 OUTLIER 75.99 110.55 0.07 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.158 -0.474 . . . . 44.41 111.131 -179.957 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . 1.002 HD21 HG21 ' A' ' 186' ' ' ILE . 0.6 OUTLIER -96.1 -53.35 3.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.133 -0.485 . . . . 75.02 110.882 179.995 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . 0.573 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -161.63 147.71 13.91 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.209 -0.451 . . . . 71.42 111.069 179.8 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 24.5 p-80 -109.63 125.72 52.88 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 72.02 110.86 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -109.41 171.25 7.55 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.193 -0.458 . . . . 74.42 111.105 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -125.9 153.28 44.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 75.31 110.856 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . 0.757 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -86.27 165.46 33.54 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.605 0.717 . . . . 61.04 111.061 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 162' ' ' PRO . . . . . 0.757 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.7 Cg_endo -69.73 75.52 1.19 Allowed 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.696 2.264 . . . . 74.44 112.36 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -136.29 102.61 0.41 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.708 -0.758 . . . . 61.41 112.481 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 164' ' ' THR . . . . . 0.442 HG22 ' H ' ' A' ' 165' ' ' GLY . 0.2 OUTLIER 68.28 174.5 0.28 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.775 0.321 . . . . 73.1 111.135 -179.908 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . 0.442 ' H ' HG22 ' A' ' 164' ' ' THR . . . -52.07 -50.65 44.55 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.739 -0.743 . . . . 74.03 112.502 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 166' ' ' LEU . . . . . 0.675 HD13 ' O ' ' A' ' 166' ' ' LEU . 3.4 tm? -58.71 -31.19 68.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.845 0.355 . . . . 65.12 110.915 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -72.97 151.22 45.42 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.669 -0.777 . . . . 43.43 112.481 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 168' ' ' GLY . . . . . 0.65 ' O ' HG23 ' A' ' 134' ' ' ILE . . . 86.2 15.99 63.57 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.782 -0.723 . . . . 74.31 112.472 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -87.37 147.88 25.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.791 0.329 . . . . 63.41 110.898 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.58 130.38 56.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 74.21 111.088 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 171' ' ' HIS . . . . . 0.55 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 50.0 m170 -131.43 139.04 49.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.244 -0.435 . . . . 72.53 110.807 -179.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 48.5 m-85 -122.34 140.07 53.08 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.184 -0.462 . . . . 71.44 110.858 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 63.5 t0 -69.14 98.25 0.99 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.196 -0.456 . . . . 74.11 110.853 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.94 -16.46 12.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.157 -0.474 . . . . 72.25 110.857 -179.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -79.25 -16.25 56.76 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.112 -0.494 . . . . 73.32 110.85 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 27.8 mm-40 -81.99 -176.78 6.31 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.166 -0.47 . . . . 63.2 110.918 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 32.3 mtm180 -116.49 114.4 24.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 63.14 110.917 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 5.7 m95 -117.24 150.33 38.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.244 -0.434 . . . . 72.31 110.855 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 179' ' ' THR . . . . . 0.581 HG21 ' HB3' ' A' ' 182' ' ' SER . 12.2 t -179.82 163.87 1.16 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.231 -0.441 . . . . 74.13 111.14 -179.934 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -122.27 -67.53 0.95 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.253 -0.43 . . . . 45.33 110.839 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -67.49 -10.73 58.29 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.748 -0.739 . . . . 62.41 112.495 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 182' ' ' SER . . . . . 0.581 ' HB3' HG21 ' A' ' 179' ' ' THR . 0.2 OUTLIER -98.28 -24.51 15.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.856 0.36 . . . . 64.5 110.888 -179.768 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 183' ' ' SER . . . . . 0.458 ' C ' ' O ' ' A' ' 182' ' ' SER . 53.0 p 32.69 61.58 0.36 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.085 -0.507 . . . . 64.12 110.877 -179.83 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 6.0 tt -116.89 -33.7 4.68 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 74.2 110.894 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -121.33 -136.45 5.04 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.734 -0.746 . . . . 73.01 112.503 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 186' ' ' ILE . . . . . 1.002 HG21 HD21 ' A' ' 156' ' ' LEU . 7.7 mm -79.36 97.41 2.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.871 0.367 . . . . 73.22 111.165 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -50.94 121.32 5.84 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.154 -0.476 . . . . 71.31 110.879 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 188' ' ' PHE . . . . . 0.753 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.5 t80 -54.2 -35.68 62.64 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.224 -0.444 . . . . 75.45 110.913 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . 0.52 HD12 ' HE2' ' A' ' 224' ' ' PHE . 0.2 OUTLIER -67.37 -48.17 68.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.094 -0.503 . . . . 52.02 110.865 -179.998 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 9.7 t80 -69.88 -37.45 76.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.152 -0.476 . . . . 74.22 110.935 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 191' ' ' ALA . . . . . 0.662 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -72.55 -35.9 68.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.099 -0.501 . . . . 50.03 111.092 179.895 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 192' ' ' ALA . . . . . 0.66 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -57.13 -45.19 83.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.251 -0.431 . . . . 52.11 111.105 179.952 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.78 -41.03 85.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.189 -0.46 . . . . 72.43 111.162 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 13.9 t-160 -73.1 -44.97 59.66 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.215 -0.448 . . . . 71.44 110.872 179.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -69.48 -48.15 61.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.244 -0.435 . . . . 71.01 111.101 179.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 196' ' ' LEU . . . . . 1.016 HD12 HD13 ' A' ' 113' ' ' LEU . 4.4 mm? -64.06 -39.42 94.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.114 -0.493 . . . . 74.51 110.909 -179.908 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -63.31 -25.15 68.13 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.745 -0.741 . . . . 52.23 112.526 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 198' ' ' HIS . . . . . . . . . . . . . 5.5 m-70 -68.7 -43.6 75.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.834 0.35 . . . . 75.21 110.857 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . 0.46 ' O ' ' HD3' ' A' ' 162' ' ' PRO . 0.2 OUTLIER -58.83 -25.68 63.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.233 -0.439 . . . . 71.13 110.921 -179.788 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -85.05 1.13 49.11 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.104 -0.498 . . . . 64.13 110.891 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 85.19 -9.36 67.02 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.787 -0.72 . . . . 50.41 112.525 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 202' ' ' MET . . . . . 0.448 ' CE ' ' HB ' ' A' ' 234' ' ' ILE . 0.0 OUTLIER -54.2 134.52 44.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.808 0.337 . . . . 63.21 110.828 -179.964 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -101.05 172.69 23.66 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.719 -0.753 . . . . 64.44 112.465 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 204' ' ' HIS . . . . . 0.42 ' HA ' ' HB3' ' A' ' 212' ' ' MET . 20.7 m-70 -67.45 163.64 20.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.827 0.346 . . . . 74.32 110.864 -179.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -124.66 153.47 42.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.223 -0.444 . . . . 53.34 110.856 -179.781 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 3.1 p -87.64 -4.27 58.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.156 -0.475 . . . . 72.22 110.819 -179.775 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.19 135.88 84.62 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.58 0.705 . . . . 65.11 110.924 179.952 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -69.83 -6.15 17.95 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.594 2.196 . . . . 74.53 112.292 -179.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -130.05 29.96 4.87 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.227 -0.442 . . . . 63.52 110.9 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 210' ' ' ALA . . . . . 0.478 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.27 145.33 26.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.142 -0.481 . . . . 62.23 111.09 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 211' ' ' VAL . . . . . 0.448 HG12 ' OD2' ' A' ' 230' ' ' ASP . 0.4 OUTLIER -67.21 -27.67 39.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.153 -0.476 . . . . 62.04 111.199 179.933 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 212' ' ' MET . . . . . 0.42 ' HB3' ' HA ' ' A' ' 204' ' ' HIS . 1.3 ttm -97.11 8.61 44.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.13 -0.486 . . . . 75.22 110.861 179.918 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 213' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -55.78 116.55 12.44 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.697 0.761 . . . . 73.43 110.845 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.89 -18.41 36.43 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.711 2.274 . . . . 63.01 112.282 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.7 51.1 2.05 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.239 -0.437 . . . . 74.24 111.139 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 8.4 t80 -77.14 128.8 35.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.265 -0.425 . . . . 74.14 110.974 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -164.34 -130.22 1.11 Allowed Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.669 -0.777 . . . . 74.22 112.421 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -51.78 149.99 4.35 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.879 0.371 . . . . 64.22 110.895 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . 87.69 99.59 0.89 Allowed Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.754 -0.736 . . . . 72.24 112.494 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 220' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -112.69 101.49 52.92 Favored Pre-proline 0 C--N 1.328 -0.356 0 CA-C-O 121.711 0.767 . . . . 41.43 110.865 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.72 124.83 11.48 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.652 2.234 . . . . 73.42 112.341 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -80.57 -20.54 43.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.258 -0.428 . . . . 74.21 110.87 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -129.32 37.24 4.05 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.183 -0.462 . . . . 60.33 110.87 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 224' ' ' PHE . . . . . 0.52 ' HE2' HD12 ' A' ' 189' ' ' LEU . 0.3 OUTLIER -52.33 157.39 1.45 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.162 -0.472 . . . . 65.01 110.862 179.972 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 3.0 mttp -144.51 168.99 18.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.093 -0.503 . . . . 64.24 110.866 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . 0.819 HD13 ' HG2' ' A' ' 119' ' ' GLU . 21.9 mt -60.08 148.82 34.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 53.44 110.845 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 227' ' ' SER . . . . . 0.505 ' O ' HG12 ' A' ' 231' ' ' ILE . 0.0 OUTLIER -86.93 150.78 23.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.147 -0.479 . . . . 74.21 110.853 -179.95 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -64.38 -64.21 0.94 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.113 -0.494 . . . . 74.54 110.859 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 229' ' ' ASP . . . . . 0.404 ' HA ' ' HG2' ' A' ' 232' ' ' LYS . 17.9 t70 -55.48 -26.92 45.21 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.174 -0.466 . . . . 72.22 110.864 -179.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 230' ' ' ASP . . . . . 0.448 ' OD2' HG12 ' A' ' 211' ' ' VAL . 61.7 t0 -69.73 -50.23 45.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.155 -0.475 . . . . 74.23 110.896 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 231' ' ' ILE . . . . . 0.675 HD11 HD22 ' A' ' 226' ' ' LEU . 3.9 mm -69.75 -40.59 79.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.183 -0.462 . . . . 73.41 111.154 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 232' ' ' LYS . . . . . 0.411 ' HG3' ' N ' ' A' ' 233' ' ' GLY . 0.0 OUTLIER -56.46 -31.93 64.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.222 -0.445 . . . . 65.42 110.918 179.835 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 233' ' ' GLY . . . . . 0.411 ' N ' ' HG3' ' A' ' 232' ' ' LYS . . . -64.82 -49.72 62.04 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.729 -0.748 . . . . 63.43 112.529 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 234' ' ' ILE . . . . . 0.448 ' HB ' ' CE ' ' A' ' 202' ' ' MET . 8.4 tt -72.99 -30.28 31.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 120.76 0.314 . . . . 71.54 111.104 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -61.46 -29.29 69.87 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.233 -0.439 . . . . 70.33 110.896 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 236' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.58 -25.46 59.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.267 -0.424 . . . . 51.21 110.887 -179.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 237' ' ' LEU . . . . . 0.708 HD22 ' HD3' ' A' ' 83' ' ' LYS . 9.7 tt -97.42 -26.22 14.93 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.259 -0.428 . . . . 75.41 110.899 179.89 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 238' ' ' TYR . . . . . 0.44 ' CD1' HG13 ' A' ' 234' ' ' ILE . 5.4 m-85 -92.44 -35.38 13.69 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.235 -0.439 . . . . 51.24 110.881 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -149.34 -118.23 0.92 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.735 -0.745 . . . . 32.22 112.482 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 15.8 ttmm -86.73 148.28 25.49 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.827 0.346 . . . . 75.42 110.878 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -80.29 -169.11 1.93 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.197 -0.456 . . . . 73.34 110.893 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 5.5 m -143.02 -69.9 0.33 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.247 -0.433 . . . . 62.42 110.874 -179.787 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -133.97 -41.44 0.83 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.11 -0.495 . . . . 72.13 110.954 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 63.22 99.14 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.146 -0.479 . . . . 62.23 110.837 -179.9 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 1.1 ttm180 -136.68 -66.01 0.54 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.172 -0.467 . . . . 70.43 110.912 -179.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 52.04 78.51 0.12 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.165 -0.471 . . . . 72.11 110.911 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 16.0 ptmt . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.194 -0.457 . . . . 74.13 110.874 179.877 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 302' ' ' ' CA' . . . . . 0.636 'CA ' ' O ' ' A' ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' -2' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.233 0.191 0 CA-C-O 121.624 0.726 . . . . 73.02 110.895 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' -1' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.76 172.08 13.29 Favored 'Trans proline' 0 C--O 1.232 0.221 0 C-N-CA 122.701 2.267 . . . . 71.15 112.332 179.877 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 0' ' ' LEU . . . . . 0.461 HD23 ' HG3' ' A' ' 3' ' ' GLU . 11.8 tp -174.76 72.52 0.3 Allowed Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.525 0.678 . . . . 62.13 110.888 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.72 -179.63 3.03 Favored 'Trans proline' 0 C--O 1.231 0.154 0 C-N-CA 122.682 2.255 . . . . 64.14 112.356 179.83 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 39.58 40.86 0.67 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.211 -0.45 . . . . 60.51 110.873 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.461 ' HG3' HD23 ' A' ' 0' ' ' LEU . 0.1 OUTLIER -95.44 -52.86 3.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.209 -0.451 . . . . 74.01 110.87 -179.99 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.404 ' O ' ' HE2' ' A' ' 7' ' ' MET . . . -68.46 -33.97 75.12 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.214 -0.448 . . . . 71.4 111.076 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -55.9 -25.14 44.35 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.745 -0.741 . . . . 60.51 112.505 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -108.94 21.3 27.65 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.728 -0.749 . . . . 54.22 112.451 -179.881 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . 0.404 ' HE2' ' O ' ' A' ' 4' ' ' ALA . 1.0 OUTLIER -84.74 164.2 18.69 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.812 0.339 . . . . 72.23 110.832 -179.938 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -112.45 168.24 9.8 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.206 -0.452 . . . . 73.24 110.911 -179.842 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -54.56 -31.92 57.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.183 -0.462 . . . . 50.12 110.95 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.72 -42.87 85.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.185 -0.461 . . . . 72.33 110.901 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -61.81 -42.53 99.13 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.125 -0.489 . . . . 72.14 110.913 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 6.5 t-105 -73.19 -33.26 65.31 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.207 -0.452 . . . . 71.22 110.847 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -63.96 -36.67 84.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.341 -0.39 . . . . 72.51 110.902 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -63.07 -36.89 85.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 61.24 110.897 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.646 ' HB1' ' HE3' ' A' ' 62' ' ' MET . . . -57.16 -37.36 71.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.166 -0.47 . . . . 54.34 111.099 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.695 ' NE2' HD12 ' A' ' 35' ' ' LEU . 0.7 OUTLIER -67.16 -43.0 83.38 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.2 -0.455 . . . . 73.12 110.917 -179.932 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -70.08 -31.41 68.99 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.162 -0.472 . . . . 72.4 110.882 180.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 14.8 m-85 -67.68 -50.5 57.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.188 -0.46 . . . . 75.11 110.948 -179.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.488 HD13 ' C ' ' A' ' 19' ' ' LEU . 2.8 tm? -67.82 -33.46 74.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.094 -0.503 . . . . 72.51 110.836 -179.94 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 4.9 tptt -57.15 -39.82 76.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.196 -0.456 . . . . 74.41 110.902 179.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.463 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 8.8 ptm180 -83.91 -25.29 30.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.242 -0.435 . . . . 74.05 110.917 179.912 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.427 ' HB2' ' HA ' ' A' ' 19' ' ' LEU . 0.4 OUTLIER -59.08 -20.17 50.93 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 74.31 110.865 -179.936 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.659 ' CE2' ' HB2' ' A' ' 24' ' ' LEU . 3.8 p90 -120.57 -49.54 2.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.182 -0.463 . . . . 72.55 110.958 -179.868 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.659 ' HB2' ' CE2' ' A' ' 23' ' ' TYR . 49.5 mt -166.38 -119.76 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.127 -0.488 . . . . 75.43 110.912 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.483 ' HB2' ' O ' ' A' ' 24' ' ' LEU . 0.3 OUTLIER 175.24 89.36 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.195 -0.457 . . . . 71.41 110.914 -179.957 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 62.1 m-20 -125.3 90.28 3.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.126 -0.488 . . . . 74.25 110.868 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.3 p -50.07 -28.21 6.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.243 -0.435 . . . . 62.15 110.876 -179.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -56.01 -33.17 64.64 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.057 -0.519 . . . . 74.51 110.877 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 87.5 m -79.98 -20.39 45.63 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.172 -0.467 . . . . 70.44 111.084 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.7 tttt -50.99 103.61 0.06 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.209 -0.45 . . . . 73.33 110.867 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -175.42 164.84 3.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.222 -0.444 . . . . 64.43 110.878 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.56 -37.34 63.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.147 -0.478 . . . . 70.21 111.121 179.826 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -69.58 -47.56 63.16 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.179 -0.464 . . . . 35.31 110.865 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.12 -22.98 62.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.185 -0.462 . . . . 74.02 110.829 -179.876 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.695 HD12 ' NE2' ' A' ' 16' ' ' GLN . 1.3 tt -58.76 -44.35 90.57 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.197 -0.456 . . . . 72.52 110.861 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.445 ' N ' HD23 ' A' ' 35' ' ' LEU . 1.1 tp10 -57.24 -52.64 64.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.268 -0.424 . . . . 73.13 110.931 179.911 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.48 -36.76 84.83 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.153 -0.476 . . . . 63.32 111.1 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.459 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 2.7 mmtm -65.19 -49.13 70.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.189 -0.46 . . . . 72.32 110.861 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 35' ' ' LEU . 4.6 mt -62.64 -35.54 79.93 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.209 -0.45 . . . . 72.11 110.874 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 26.0 tttt -60.1 -45.6 92.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.191 -0.459 . . . . 62.43 110.888 179.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.459 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 1.7 pt-20 -60.56 -32.73 71.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.192 -0.458 . . . . 75.11 110.877 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.537 ' HE2' HD11 ' A' ' 61' ' ' ILE . 13.9 ttt -65.68 -34.05 77.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.145 -0.48 . . . . 63.43 110.887 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.752 ' OE1' HD11 ' A' ' 48' ' ' LEU . 2.7 mm-40 -64.11 -39.65 94.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.239 -0.437 . . . . 74.45 110.847 -179.929 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.2 mmpt? -68.52 -29.21 67.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.192 -0.458 . . . . 71.43 110.915 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -70.05 -42.31 73.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 73.32 110.923 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.584 ' HB3' HD23 ' A' ' 48' ' ' LEU . 10.4 m-85 -82.1 -35.33 28.7 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.206 -0.452 . . . . 70.43 110.803 -179.871 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.402 ' HA3' ' HB2' ' A' ' 206' ' ' SER . . . 104.74 -10.15 48.68 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.718 -0.753 . . . . 64.34 112.414 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.752 HD11 ' OE1' ' A' ' 43' ' ' GLN . 0.7 OUTLIER -60.66 138.57 93.05 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.607 0.718 . . . . 64.11 110.941 -179.927 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.702 ' O ' HG23 ' A' ' 51' ' ' THR . 53.9 Cg_endo -69.73 -53.25 0.28 Allowed 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.643 2.229 . . . . 74.5 112.386 179.844 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.438 ' O ' HD12 ' A' ' 48' ' ' LEU . 0.9 OUTLIER -52.39 108.23 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.242 -0.435 . . . . 71.22 111.137 179.847 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.702 HG23 ' O ' ' A' ' 49' ' ' PRO . 68.2 p -116.22 168.53 10.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.214 -0.448 . . . . 73.25 111.174 179.917 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 65.19 12.51 55.52 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.763 -0.732 . . . . 64.24 112.495 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.2 ppp? -124.72 161.12 27.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.836 0.35 . . . . 75.23 110.868 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.546 HD21 ' CB ' ' A' ' 15' ' ' ALA . 18.4 tp -162.53 94.03 0.86 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.213 -0.449 . . . . 73.4 110.933 179.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.413 ' HA ' HG13 ' A' ' 59' ' ' ILE . 0.6 OUTLIER 172.9 -26.13 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.122 -0.49 . . . . 44.35 110.927 179.963 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 44.3 m -89.34 -100.5 0.09 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.171 -0.468 . . . . 75.25 110.851 -179.819 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 12.9 tpt180 -84.62 -28.23 26.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.126 -0.488 . . . . 61.22 110.874 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.495 HG21 HE22 ' A' ' 43' ' ' GLN . 97.3 t -62.68 -41.33 91.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.218 -0.446 . . . . 70.12 111.112 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.427 HD11 ' HB2' ' A' ' 15' ' ' ALA . 1.8 mm -74.97 -31.58 25.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.177 -0.465 . . . . 74.43 111.167 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -60.06 -44.12 94.95 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 73.45 110.86 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.653 HG21 HG23 ' A' ' 215' ' ' THR . 24.4 pt -70.34 -30.01 41.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.175 -0.466 . . . . 74.52 111.147 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.646 ' HE3' ' HB1' ' A' ' 15' ' ' ALA . 2.1 mmm -67.77 -35.26 78.38 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.144 -0.48 . . . . 74.01 110.832 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -87.67 -24.06 24.02 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.209 -0.451 . . . . 42.22 110.861 -179.874 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 50.5 mtmt -85.02 113.88 52.61 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.596 0.712 . . . . 65.34 110.864 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.78 148.05 64.07 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.71 2.273 . . . . 72.11 112.361 179.881 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.563 ' O ' HD23 ' A' ' 156' ' ' LEU . 1.5 ppt_? -154.7 -59.48 0.11 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.252 -0.431 . . . . 71.51 110.829 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -146.14 144.88 30.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.215 -0.448 . . . . 55.3 110.884 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.554 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -101.75 15.37 57.09 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.781 -0.723 . . . . 64.23 112.491 -179.922 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.598 HG12 ' HD2' ' A' ' 70' ' ' PRO . 0.1 OUTLIER -101.86 137.0 19.41 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.642 0.734 . . . . 74.23 111.111 -179.982 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.598 ' HD2' HG12 ' A' ' 69' ' ' VAL . 54.2 Cg_endo -69.82 165.41 31.12 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.632 2.221 . . . . 63.44 112.387 179.904 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -135.01 46.27 2.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.253 -0.43 . . . . 74.45 110.867 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -140.06 129.78 28.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.263 -0.426 . . . . 53.43 111.066 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -130.9 170.44 14.42 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.103 -0.498 . . . . 73.13 111.073 179.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -164.14 172.77 13.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.256 -0.429 . . . . 73.31 110.881 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 51.7 t80 -51.6 104.2 0.08 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.129 -0.487 . . . . 70.41 110.907 -179.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.5 p -140.98 178.43 7.37 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.1 -0.5 . . . . 74.2 110.852 -179.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 7.9 mt -95.96 53.95 1.44 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.121 -0.491 . . . . 70.34 110.906 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -78.04 160.18 74.26 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.655 0.741 . . . . 71.24 110.831 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 133.95 26.78 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.677 2.251 . . . . 73.34 112.336 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -51.26 137.07 23.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.191 -0.458 . . . . 74.43 110.91 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 63.65 94.8 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.689 0.757 . . . . 70.4 110.894 -179.836 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.7 -50.51 0.46 Allowed 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.661 2.24 . . . . 71.11 112.308 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.821 ' HD2' HD22 ' A' ' 237' ' ' LEU . 5.4 mttp -63.34 151.02 41.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.269 -0.423 . . . . 64.45 110.898 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . 0.686 ' CE3' HG21 ' A' ' 89' ' ' VAL . 39.7 m0 -50.97 109.49 0.33 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.198 -0.455 . . . . 73.31 110.961 179.902 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -105.02 -14.7 15.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.25 -0.432 . . . . 65.3 111.183 -179.957 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -58.16 153.5 14.82 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.188 -0.46 . . . . 70.34 110.897 -179.879 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 14.6 mmtp -65.91 -30.62 71.24 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.178 -0.465 . . . . 71.12 110.91 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.419 HG23 ' CD2' ' A' ' 123' ' ' HIS . 0.8 OUTLIER -154.79 142.25 12.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.208 -0.451 . . . . 74.14 111.132 179.934 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.686 HG21 ' CE3' ' A' ' 84' ' ' TRP . 54.8 t -123.61 139.21 50.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.183 -0.462 . . . . 72.25 111.082 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.488 ' C ' ' HB1' ' A' ' 132' ' ' ALA . 31.6 p -115.96 147.12 41.5 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.113 -0.494 . . . . 71.01 111.099 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 17.5 p90 -131.36 146.6 52.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.21 -0.45 . . . . 70.51 110.971 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 9.1 ttt180 -147.71 138.47 23.31 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.082 -0.508 . . . . 71.25 110.897 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.517 HD11 ' HA ' ' A' ' 106' ' ' ASP . 9.8 mm -75.21 135.09 27.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.223 -0.444 . . . . 72.4 111.156 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.456 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 21.1 t -91.47 -40.27 12.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.187 -0.461 . . . . 60.2 111.142 179.829 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 35.1 t -151.05 169.36 22.02 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.196 -0.456 . . . . 64.24 110.807 -179.835 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 13.2 p90 -131.86 155.09 48.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.078 -0.51 . . . . 72.25 110.95 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.7 t -103.32 141.71 35.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.129 -0.487 . . . . 64.11 111.14 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 2.1 mmt180 -52.53 -18.45 1.72 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.214 -0.448 . . . . 72.14 110.842 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.03 -37.42 87.54 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.199 -0.455 . . . . 74.13 110.86 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.617 HD11 ' HA ' ' A' ' 179' ' ' THR . 0.9 OUTLIER -142.09 152.4 61.45 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.594 0.711 . . . . 72.52 110.895 -179.957 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . 0.567 ' HB2' HG22 ' A' ' 103' ' ' ILE . 54.4 Cg_endo -69.71 151.21 69.3 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.724 2.283 . . . . 73.11 112.311 179.832 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -52.96 -26.29 14.68 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.196 -0.457 . . . . 74.11 110.814 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.567 HG22 ' HB2' ' A' ' 101' ' ' PRO . 5.5 tt -77.1 -39.51 29.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.312 -0.403 . . . . 74.02 111.124 179.9 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . 0.785 ' O ' HD22 ' A' ' 108' ' ' LEU . 3.4 m -69.12 -36.79 77.87 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.241 -0.436 . . . . 52.11 111.177 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.8 HG13 ' CZ ' ' A' ' 188' ' ' PHE . 57.5 t -71.27 -42.15 74.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.172 -0.467 . . . . 71.51 111.165 179.853 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.645 ' O ' HG22 ' A' ' 109' ' ' VAL . 22.9 t0 -68.66 -38.21 80.25 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.217 -0.447 . . . . 63.44 110.928 179.888 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . 0.483 ' HG3' ' N ' ' A' ' 108' ' ' LEU . 0.0 OUTLIER -70.0 -33.49 72.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.153 -0.476 . . . . 75.02 110.869 -179.869 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.785 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -64.64 -47.76 77.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.188 -0.46 . . . . 71.04 110.993 179.929 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.748 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.3 m -55.16 -41.32 59.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 72.31 111.201 179.797 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.464 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 44.8 t -70.0 -34.67 73.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.174 -0.466 . . . . 72.14 110.892 -179.906 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.451 ' CG ' HD21 ' A' ' 189' ' ' LEU . 0.3 OUTLIER -63.46 -34.64 78.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.11 -0.496 . . . . 74.35 110.887 179.948 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -92.27 -40.42 10.96 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.233 -0.44 . . . . 74.32 111.069 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 1.055 HD13 HD12 ' A' ' 196' ' ' LEU . 9.2 tp -64.4 -32.59 74.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.224 -0.444 . . . . 72.0 110.977 179.974 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 39.7 t30 -66.66 -38.77 87.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.209 -0.45 . . . . 72.34 110.886 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . 0.734 ' O ' HD11 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -60.84 -34.7 74.97 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.167 -0.469 . . . . 54.12 110.906 179.906 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' TRP . . . . . 0.407 ' O ' HG12 ' A' ' 120' ' ' ILE . 8.7 m95 -68.52 -38.81 81.22 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.186 -0.461 . . . . 75.23 110.872 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . 0.451 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -73.64 -33.91 57.48 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.76 -0.733 . . . . 73.32 112.456 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.7 -15.04 57.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.722 0.296 . . . . 72.42 110.863 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.807 ' HB2' HG23 ' A' ' 231' ' ' ILE . 5.1 pt-20 -106.25 13.56 28.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.264 -0.426 . . . . 75.24 110.954 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.998 HD12 HD12 ' A' ' 122' ' ' LEU . 7.3 pt -149.79 142.48 15.83 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.635 0.731 . . . . 71.34 111.157 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -69.86 25.32 0.18 Allowed 'Trans proline' 0 C--O 1.232 0.201 0 C-N-CA 122.641 2.228 . . . . 72.21 112.321 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.998 HD12 HD12 ' A' ' 120' ' ' ILE . 14.3 mt -81.49 -159.42 0.27 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.206 -0.452 . . . . 73.22 110.934 179.97 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.456 ' H ' ' HB3' ' A' ' 122' ' ' LEU . 4.1 t60 -157.25 137.26 12.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.237 -0.438 . . . . 74.12 110.929 179.857 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . 0.411 ' CE2' ' HA3' ' A' ' 117' ' ' GLY . 20.9 m-85 -117.68 138.23 52.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.197 -0.456 . . . . 75.54 110.931 -179.897 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -118.27 141.48 48.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.149 -0.478 . . . . 75.14 110.821 -179.815 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.55 154.63 27.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.171 -0.468 . . . . 72.22 110.915 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . 0.718 HG11 ' HB2' ' A' ' 132' ' ' ALA . 19.5 m -103.38 126.91 57.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.189 -0.46 . . . . 50.13 111.132 179.894 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.427 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -145.13 -25.99 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.208 -0.451 . . . . 74.43 111.152 179.901 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' TRP . . . . . 0.427 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -139.76 109.27 6.22 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.176 -0.465 . . . . 71.25 110.877 179.954 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 103.0 -167.48 17.17 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.682 -0.77 . . . . 62.11 112.469 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -101.76 156.15 17.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.741 0.305 . . . . 63.25 111.158 -179.842 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . 0.718 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -111.72 165.29 12.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.246 -0.433 . . . . 51.34 111.135 179.858 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -74.45 -44.57 51.12 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.242 -0.436 . . . . 75.41 110.893 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . 0.606 HG23 ' O ' ' A' ' 168' ' ' GLY . 3.8 mm -89.39 113.3 25.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 70.51 111.172 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . 0.456 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 8.4 mmm -101.82 122.59 44.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.177 -0.465 . . . . 72.43 110.877 179.864 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -107.0 93.42 2.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 70.04 111.123 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -130.17 173.1 20.03 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.709 -0.757 . . . . 63.34 112.418 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' PHE . . . . . 0.553 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 51.4 m-85 -108.48 149.83 28.26 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.854 0.359 . . . . 74.01 110.904 -179.877 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.553 ' HB2' ' O ' ' A' ' 138' ' ' PHE . . . 170.35 166.12 0.07 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.165 -0.47 . . . . 71.21 111.118 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.45 ' HB2' ' CB ' ' A' ' 149' ' ' PHE . 1.9 ptt180 -109.59 174.14 6.0 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.234 -0.439 . . . . 62.21 110.908 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . 0.452 ' H ' ' HA ' ' A' ' 149' ' ' PHE . . . -55.34 -18.93 15.53 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.676 -0.773 . . . . 74.24 112.53 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . 0.461 ' HB2' ' HD2' ' A' ' 149' ' ' PHE . . . -91.43 13.18 18.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.793 0.33 . . . . 75.03 111.082 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . 0.517 ' HB3' ' HB1' ' A' ' 139' ' ' ALA . 2.2 p80 -77.91 -15.75 58.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.212 -0.449 . . . . 71.11 110.855 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 128.27 49.62 0.15 Allowed Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.74 -0.743 . . . . 45.51 112.492 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -153.26 169.55 22.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.827 0.346 . . . . 72.14 110.863 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.38 165.47 11.81 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.216 -0.447 . . . . 51.25 110.902 -179.799 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 12.6 m-85 64.75 134.07 0.04 OUTLIER Pre-proline 0 C--N 1.327 -0.377 0 CA-C-O 121.724 0.773 . . . . 73.4 110.919 -179.843 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 151.35 68.85 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.674 2.249 . . . . 74.53 112.337 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 149' ' ' PHE . . . . . 0.461 ' HD2' ' HB2' ' A' ' 142' ' ' ALA . 10.4 p90 -53.19 -44.63 68.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.265 -0.425 . . . . 63.52 110.861 -179.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 75.52 -21.23 0.31 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.088 -0.506 . . . . 63.11 110.882 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . 0.45 ' H ' ' C ' ' A' ' 149' ' ' PHE . . . 68.04 -139.83 35.06 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.726 -0.749 . . . . 71.41 112.434 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.69 142.43 48.2 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.647 2.231 . . . . 75.11 112.357 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . 0.449 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 104.38 -143.47 15.69 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.768 -0.73 . . . . 70.32 112.437 179.918 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 154' ' ' ASN . . . . . 0.449 ' C ' ' O ' ' A' ' 153' ' ' GLY . 4.1 p30 -34.52 141.23 0.06 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.922 0.392 . . . . 73.25 110.867 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 75.72 117.88 0.06 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.126 -0.488 . . . . 44.41 111.098 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . 1.047 HD21 HG21 ' A' ' 186' ' ' ILE . 1.2 tp -107.07 -51.8 2.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.464 . . . . 75.02 110.955 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . 0.554 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -154.67 149.58 26.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.209 -0.45 . . . . 71.42 111.025 179.787 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 29.3 p-80 -116.39 110.94 19.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.172 -0.467 . . . . 72.02 110.816 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -110.95 170.3 8.19 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.313 -0.403 . . . . 74.42 111.118 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -146.65 164.35 32.94 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.208 -0.451 . . . . 75.31 110.868 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . 0.729 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -93.74 164.99 18.96 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.498 0.666 . . . . 61.04 111.16 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 162' ' ' PRO . . . . . 0.729 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 54.1 Cg_endo -69.76 77.23 1.08 Allowed 'Trans proline' 0 C--O 1.231 0.169 0 C-N-CA 122.726 2.284 . . . . 74.44 112.35 -179.942 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -112.41 120.42 5.29 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.741 -0.742 . . . . 61.41 112.457 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 1.2 m 76.17 -58.97 0.52 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.789 0.328 . . . . 73.1 111.148 -179.827 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . 172.1 -56.49 0.17 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.784 -0.722 . . . . 74.03 112.483 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 166' ' ' LEU . . . . . 0.461 HD23 ' O ' ' A' ' 166' ' ' LEU . 1.3 tt -60.81 -18.08 53.37 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.83 0.348 . . . . 65.12 110.925 -179.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -71.03 176.91 36.25 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.757 -0.735 . . . . 43.43 112.494 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 168' ' ' GLY . . . . . 0.606 ' O ' HG23 ' A' ' 134' ' ' ILE . . . 76.47 13.63 83.22 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.711 -0.757 . . . . 74.31 112.536 -179.88 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -94.05 149.69 21.01 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.822 0.344 . . . . 63.41 110.887 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.33 130.9 55.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.249 -0.432 . . . . 74.21 111.148 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 171' ' ' HIS . . . . . 0.448 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 62.9 m170 -128.05 132.75 49.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.218 -0.446 . . . . 72.53 110.906 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 30.3 m-85 -112.04 139.2 47.75 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.216 -0.447 . . . . 71.44 110.919 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -70.22 99.74 1.57 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.206 -0.452 . . . . 74.11 110.869 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.78 -16.67 12.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.231 -0.441 . . . . 72.25 110.893 -179.896 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 -76.25 -16.07 59.88 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.182 -0.463 . . . . 73.32 110.859 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -87.95 -176.22 5.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 63.2 110.88 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 48.0 mtm180 -110.83 119.74 40.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.158 -0.474 . . . . 63.14 110.93 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 48.9 m95 -117.04 139.16 51.03 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.256 -0.429 . . . . 72.31 110.934 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 179' ' ' THR . . . . . 0.617 ' HA ' HD11 ' A' ' 100' ' ' LEU . 7.1 t -177.33 163.51 2.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.267 -0.424 . . . . 74.13 111.151 -179.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -125.65 -68.55 0.83 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.233 -0.44 . . . . 45.33 110.916 179.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -65.26 -11.16 51.34 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.745 -0.74 . . . . 62.41 112.416 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 182' ' ' SER . . . . . 0.46 ' HB2' HG21 ' A' ' 179' ' ' THR . 1.5 m -97.34 -24.42 15.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.833 0.349 . . . . 64.5 110.907 -179.831 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 183' ' ' SER . . . . . 0.438 ' C ' ' O ' ' A' ' 182' ' ' SER . 12.1 m 34.82 61.76 0.57 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.147 -0.479 . . . . 64.12 110.88 -179.824 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -116.9 -33.59 4.71 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.067 -0.515 . . . . 74.2 110.942 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -122.3 -136.38 4.9 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.671 -0.776 . . . . 73.01 112.442 179.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 186' ' ' ILE . . . . . 1.047 HG21 HD21 ' A' ' 156' ' ' LEU . 8.2 mm -79.41 99.53 3.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.814 0.34 . . . . 73.22 111.138 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -50.29 121.79 6.06 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.18 -0.464 . . . . 71.31 110.844 -179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 188' ' ' PHE . . . . . 0.8 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.7 t80 -53.85 -34.84 60.54 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.207 -0.451 . . . . 75.45 110.905 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . 0.451 HD21 ' CG ' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -67.25 -47.46 70.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 52.02 110.905 -179.966 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 13.1 m-30 -69.47 -41.44 76.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.226 -0.443 . . . . 74.22 110.893 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 191' ' ' ALA . . . . . 0.611 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -68.38 -35.91 78.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.177 -0.465 . . . . 50.03 111.094 179.846 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 192' ' ' ALA . . . . . 0.66 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -58.56 -44.61 89.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.199 -0.455 . . . . 52.11 111.125 179.919 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 193' ' ' THR . . . . . 0.5 HG21 HG21 ' A' ' 211' ' ' VAL . 0.9 OUTLIER -58.24 -42.9 87.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.152 -0.476 . . . . 72.43 111.178 -179.904 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 8.0 t-160 -72.84 -41.64 64.59 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.215 -0.448 . . . . 71.44 110.876 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -71.44 -47.92 52.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 71.01 111.095 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 196' ' ' LEU . . . . . 1.055 HD12 HD13 ' A' ' 113' ' ' LEU . 4.4 mm? -63.82 -44.34 93.54 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.312 -0.404 . . . . 74.51 110.955 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -58.85 -27.47 61.94 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.698 -0.763 . . . . 52.23 112.552 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 198' ' ' HIS . . . . . 0.407 ' CD2' HG21 ' A' ' 69' ' ' VAL . 4.9 m-70 -67.38 -43.79 80.52 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.778 0.323 . . . . 75.21 110.909 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.15 -26.33 64.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.232 -0.44 . . . . 71.13 110.855 -179.794 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -83.98 2.96 36.38 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.138 -0.483 . . . . 64.13 110.926 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 83.52 -8.04 66.55 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.759 -0.734 . . . . 50.41 112.469 179.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 202' ' ' MET . . . . . 0.555 ' SD ' HD12 ' A' ' 234' ' ' ILE . 0.0 OUTLIER -49.84 134.84 20.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.833 0.349 . . . . 63.21 110.85 -179.975 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -102.66 159.1 17.72 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.727 -0.749 . . . . 64.44 112.468 -179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 29.2 m-70 -58.7 158.26 8.21 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.786 0.327 . . . . 74.32 110.899 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -124.09 138.97 54.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.253 -0.43 . . . . 53.34 110.939 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 206' ' ' SER . . . . . 0.402 ' HB2' ' HA3' ' A' ' 47' ' ' GLY . 3.1 p -76.79 -4.46 43.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.131 -0.486 . . . . 72.22 110.829 -179.742 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.71 135.09 83.58 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.624 0.726 . . . . 65.11 110.899 179.904 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.72 -6.3 18.26 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.709 2.273 . . . . 74.53 112.328 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -123.1 22.89 9.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.222 -0.444 . . . . 63.52 110.942 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 210' ' ' ALA . . . . . 0.494 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.13 145.63 26.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.15 -0.477 . . . . 62.23 111.144 179.851 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 211' ' ' VAL . . . . . 0.5 HG21 HG21 ' A' ' 193' ' ' THR . 0.4 OUTLIER -69.56 -28.05 36.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.261 -0.427 . . . . 62.04 111.06 -179.987 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 8.5 mmm -95.4 12.91 27.59 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.197 -0.456 . . . . 75.22 110.871 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 213' ' ' TYR . . . . . 0.417 ' CE2' ' HB ' ' A' ' 215' ' ' THR . 1.9 t80 -54.88 112.29 3.9 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-O 121.672 0.748 . . . . 73.43 110.898 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 214' ' ' PRO . . . . . 0.415 ' HD2' ' HA ' ' A' ' 213' ' ' TYR . 53.9 Cg_endo -69.82 -17.62 37.18 Favored 'Trans proline' 0 C--O 1.233 0.234 0 C-N-CA 122.698 2.266 . . . . 63.01 112.285 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 215' ' ' THR . . . . . 0.653 HG23 HG21 ' A' ' 61' ' ' ILE . 0.2 OUTLIER -83.48 59.53 5.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.29 -0.414 . . . . 74.24 111.127 -179.956 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -49.93 122.7 6.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.223 -0.444 . . . . 74.14 110.861 -179.906 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . 137.23 95.1 0.38 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.718 -0.754 . . . . 74.22 112.431 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 1.4 t30 179.71 -168.48 0.1 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.843 0.354 . . . . 64.22 110.877 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . -50.31 107.39 0.34 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.719 -0.753 . . . . 72.24 112.515 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 220' ' ' ASP . . . . . 0.403 ' HA ' ' HD2' ' A' ' 221' ' ' PRO . 2.9 p-10 -75.22 113.88 29.87 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.54 0.686 . . . . 41.43 110.916 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 221' ' ' PRO . . . . . 0.403 ' HD2' ' HA ' ' A' ' 220' ' ' ASP . 53.8 Cg_endo -69.74 150.42 68.33 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.654 2.236 . . . . 73.42 112.364 -179.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.39 -31.21 33.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.217 -0.447 . . . . 74.21 110.977 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -124.5 -28.18 3.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.128 -0.487 . . . . 60.33 110.891 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER 67.04 141.3 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.16 -0.473 . . . . 65.01 110.823 179.97 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.92 163.43 32.82 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.08 -0.509 . . . . 64.24 110.851 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . 0.734 HD11 ' O ' ' A' ' 115' ' ' MET . 11.5 mt -60.75 148.98 37.06 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.199 -0.455 . . . . 53.44 110.951 179.863 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 227' ' ' SER . . . . . 0.494 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 1.2 t -87.51 151.89 22.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.231 -0.441 . . . . 74.21 110.804 -179.882 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 19.7 tt0 -62.34 -66.07 0.59 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.146 -0.479 . . . . 74.54 110.809 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -55.55 -26.19 41.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.191 -0.459 . . . . 72.22 110.885 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -69.15 -48.12 63.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.179 -0.464 . . . . 74.23 110.867 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 231' ' ' ILE . . . . . 0.807 HG23 ' HB2' ' A' ' 119' ' ' GLU . 7.9 mt -68.3 -43.21 84.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.197 -0.456 . . . . 73.41 111.059 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 2.0 pttp -62.84 -31.85 72.95 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.232 -0.44 . . . . 65.42 110.915 179.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -62.62 -49.95 68.68 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.813 -0.708 . . . . 63.43 112.473 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 234' ' ' ILE . . . . . 0.555 HD12 ' SD ' ' A' ' 202' ' ' MET . 6.7 tt -73.07 -30.83 32.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.865 0.364 . . . . 71.54 111.174 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -68.67 -24.03 64.47 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.123 -0.489 . . . . 70.33 110.977 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 236' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.76 -28.17 60.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.126 -0.488 . . . . 51.21 110.915 179.911 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 237' ' ' LEU . . . . . 0.821 HD22 ' HD2' ' A' ' 83' ' ' LYS . 10.3 tt -98.02 -29.36 13.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.149 -0.478 . . . . 75.41 110.889 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 238' ' ' TYR . . . . . 0.492 ' CE2' HD11 ' A' ' 122' ' ' LEU . 27.9 m-85 -91.99 -35.46 13.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.245 -0.434 . . . . 51.24 110.916 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -134.24 -119.92 2.02 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.784 -0.722 . . . . 32.22 112.479 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 3.6 ttpp -125.06 121.04 33.19 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.812 0.339 . . . . 75.42 110.952 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 1.5 tpt180 179.91 178.37 0.59 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 73.34 110.886 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 1.4 p 52.9 -171.07 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.175 -0.466 . . . . 62.42 110.868 -179.803 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 9.2 p-10 -165.87 -40.89 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.148 -0.478 . . . . 72.13 110.902 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 14.8 p -139.54 -173.52 3.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.208 -0.451 . . . . 62.23 110.859 -179.829 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 1.3 ptm180 -69.26 153.23 43.98 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.185 -0.462 . . . . 70.43 110.891 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -173.23 -45.57 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 72.11 110.875 179.942 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 116.284 -0.417 . . . . 74.13 110.901 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 302' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' -2' ' ' LEU . . . . . . . . . . . . . 16.8 tp . . . . . 0 C--O 1.232 0.153 0 CA-C-O 121.68 0.752 . . . . 73.02 110.953 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' -1' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.71 177.66 5.32 Favored 'Trans proline' 0 C--O 1.233 0.235 0 C-N-CA 122.718 2.279 . . . . 71.15 112.352 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 2.2 mt -133.94 73.36 71.07 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-O 121.687 0.756 . . . . 62.13 110.951 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.68 -173.67 0.75 Allowed 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.731 2.287 . . . . 64.14 112.373 179.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 -86.09 99.78 11.72 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.246 -0.434 . . . . 60.51 110.902 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -95.27 -25.52 16.31 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.225 -0.443 . . . . 74.01 110.876 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.438 ' HB2' ' HB2' ' A' ' 55' ' ' ASN . . . -56.53 -34.08 66.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.184 -0.462 . . . . 71.4 111.085 179.872 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -55.91 -24.81 43.29 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.755 -0.736 . . . . 60.51 112.541 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -108.79 20.57 29.13 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.759 -0.734 . . . . 54.22 112.481 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 3.0 mtp -97.76 162.82 13.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.8 0.334 . . . . 72.23 110.844 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -112.77 168.49 9.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.282 -0.417 . . . . 73.24 110.887 -179.804 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -55.63 -32.08 62.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.201 -0.454 . . . . 50.12 110.852 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -63.48 -42.77 98.55 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.211 -0.45 . . . . 72.33 110.944 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.8 -42.91 99.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.162 -0.472 . . . . 72.14 110.896 179.894 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 19.4 t-105 -73.04 -32.98 65.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.166 -0.47 . . . . 71.22 110.886 -179.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -72.26 -42.2 65.89 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.19 -0.459 . . . . 72.51 110.892 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -63.54 -36.85 85.15 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.156 -0.475 . . . . 61.24 110.944 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.19 -34.85 68.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.113 -0.494 . . . . 54.34 111.104 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -69.88 -37.83 76.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.242 -0.435 . . . . 73.12 110.987 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.406 ' HA ' ' HD2' ' A' ' 20' ' ' LYS . 1.9 m-20 -77.47 -31.56 53.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.179 -0.464 . . . . 72.4 110.811 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 4.0 m-30 -59.79 -36.09 75.99 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.212 -0.449 . . . . 75.11 110.897 -179.794 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.656 HD13 ' O ' ' A' ' 19' ' ' LEU . 2.9 tm? -72.11 -21.01 61.54 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.146 -0.479 . . . . 72.51 110.876 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.406 ' HD2' ' HA ' ' A' ' 17' ' ' ASP . 1.4 ptmt -77.62 -26.56 50.65 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.219 -0.446 . . . . 74.41 110.901 179.84 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.425 ' HG3' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -83.83 -27.85 28.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.444 . . . . 74.05 110.871 -179.989 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.425 ' N ' ' HG3' ' A' ' 21' ' ' ARG . 2.7 m-85 -60.79 -22.36 64.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.196 -0.456 . . . . 74.31 110.868 -179.898 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -120.38 48.14 1.64 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.206 -0.452 . . . . 72.55 110.899 -179.845 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.1 mt 70.68 -72.01 0.12 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.114 -0.494 . . . . 75.43 110.926 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -177.78 103.87 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.233 -0.44 . . . . 71.41 110.932 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -102.79 94.8 5.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.137 -0.483 . . . . 74.25 110.862 179.892 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -85.12 -20.6 30.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.138 -0.483 . . . . 62.15 110.832 -179.778 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.24 -11.26 60.65 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.18 -0.464 . . . . 74.51 110.924 -179.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.811 HG22 HD22 ' A' ' 35' ' ' LEU . 1.6 m -86.13 9.73 16.53 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.085 -0.507 . . . . 70.44 111.137 -179.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 14.4 ptmt -45.05 157.24 0.08 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.239 -0.437 . . . . 73.33 110.894 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 5.2 t30 67.31 127.4 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.208 -0.451 . . . . 64.43 110.869 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -50.48 -31.67 15.98 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.109 -0.496 . . . . 70.21 111.053 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -54.39 -34.45 61.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.226 -0.443 . . . . 35.31 110.883 -179.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 46.2 m -85.59 -30.23 23.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.166 -0.47 . . . . 74.02 110.858 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.811 HD22 HG22 ' A' ' 29' ' ' THR . 1.8 mm? -58.04 -36.3 72.54 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.108 -0.496 . . . . 72.52 110.922 179.919 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.64 -50.87 71.73 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.211 -0.449 . . . . 73.13 110.943 179.858 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.56 -36.76 84.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.122 -0.49 . . . . 63.32 111.103 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.494 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.7 OUTLIER -68.66 -49.75 56.62 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.181 -0.463 . . . . 72.32 110.865 -179.995 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' A' ' 35' ' ' LEU . 7.0 mt -56.44 -36.89 69.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.28 -0.418 . . . . 72.11 110.919 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.9 mttt -58.52 -45.56 88.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.146 -0.479 . . . . 62.43 110.878 179.856 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.494 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 2.3 pt-20 -60.43 -32.58 71.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.254 -0.43 . . . . 75.11 110.919 179.931 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.3 tmt? -68.25 -34.36 76.05 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.12 -0.491 . . . . 63.43 110.914 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.784 ' OE1' HD11 ' A' ' 48' ' ' LEU . 6.8 mm-40 -57.14 -39.64 75.6 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.265 -0.425 . . . . 74.45 110.952 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.4 mmpt? -69.9 -28.27 65.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.137 -0.483 . . . . 71.43 110.947 179.9 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 43.6 t80 -70.37 -37.56 74.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.175 -0.466 . . . . 73.32 110.895 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.722 ' HB3' HD23 ' A' ' 48' ' ' LEU . 3.0 m-85 -81.84 -35.04 29.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.158 -0.474 . . . . 70.43 110.898 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.42 ' HA2' ' HB3' ' A' ' 206' ' ' SER . . . 106.06 -10.27 43.84 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.804 -0.712 . . . . 64.34 112.478 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.784 HD11 ' OE1' ' A' ' 43' ' ' GLN . 0.8 OUTLIER -65.68 139.11 96.91 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.603 0.716 . . . . 64.11 110.931 -179.937 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.462 ' HG2' HD13 ' A' ' 50' ' ' ILE . 54.4 Cg_endo -69.72 -51.98 0.36 Allowed 'Trans proline' 0 C--O 1.232 0.22 0 C-N-CA 122.67 2.246 . . . . 74.5 112.329 179.833 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.488 ' O ' HD12 ' A' ' 48' ' ' LEU . 0.0 OUTLIER -53.01 108.15 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.223 -0.444 . . . . 71.22 111.133 179.962 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.404 ' HA ' ' HG3' ' A' ' 43' ' ' GLN . 3.7 t -119.75 155.96 31.47 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.178 -0.465 . . . . 73.25 111.109 179.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.54 -7.58 57.39 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.774 -0.727 . . . . 64.24 112.435 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 15.3 mtt -135.1 161.17 36.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.789 0.328 . . . . 75.23 110.853 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.422 ' HA ' ' HB ' ' A' ' 58' ' ' VAL . 2.8 pp -156.59 128.97 7.53 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.169 -0.469 . . . . 73.4 110.941 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.438 ' HB2' ' HB2' ' A' ' 4' ' ' ALA . 0.5 OUTLIER 176.2 -30.31 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 44.35 110.852 179.978 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 20.4 p -93.51 -88.48 0.23 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.218 -0.446 . . . . 75.25 110.821 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 2.9 mmm180 -84.71 -35.55 22.44 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.131 -0.486 . . . . 61.22 110.832 -179.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.422 ' HB ' ' HA ' ' A' ' 54' ' ' LEU . 16.6 t -60.64 -43.71 95.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.169 -0.469 . . . . 70.12 111.122 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -74.82 -31.25 25.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.244 -0.434 . . . . 74.43 111.155 179.951 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -67.17 -44.13 80.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.132 -0.485 . . . . 73.45 110.982 179.87 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.562 HD12 ' CZ ' ' A' ' 46' ' ' PHE . 37.3 pt -66.89 -30.06 48.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.184 -0.462 . . . . 74.52 111.107 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -58.47 -40.67 83.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.181 -0.463 . . . . 74.01 110.893 179.888 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 16.0 pt20 -91.66 -23.94 19.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.29 -0.414 . . . . 42.22 110.905 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 4.2 ttmm -78.8 114.43 43.79 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.549 0.69 . . . . 65.34 110.906 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.85 140.22 41.82 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.668 2.246 . . . . 72.11 112.268 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.561 ' O ' HD23 ' A' ' 156' ' ' LEU . 1.0 OUTLIER -140.78 -61.69 0.49 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.157 -0.474 . . . . 71.51 110.873 -179.961 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -145.46 151.17 37.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.157 -0.474 . . . . 55.3 110.848 -179.93 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.545 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -109.51 24.27 20.46 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.677 -0.773 . . . . 64.23 112.437 -179.943 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.616 HG12 ' HD2' ' A' ' 70' ' ' PRO . 0.2 OUTLIER -103.17 137.51 19.28 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.527 0.68 . . . . 74.23 111.177 -179.978 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.616 ' HD2' HG12 ' A' ' 69' ' ' VAL . 53.9 Cg_endo -69.69 141.92 46.84 Favored 'Trans proline' 0 N--CA 1.465 -0.152 0 C-N-CA 122.721 2.281 . . . . 63.44 112.33 179.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -94.78 22.67 6.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.47 . . . . 74.45 110.908 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -125.62 129.16 72.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.141 -0.481 . . . . 53.43 111.092 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -131.1 170.58 14.34 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.186 -0.461 . . . . 73.13 111.103 179.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -179.88 164.95 1.23 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.183 -0.462 . . . . 73.31 110.83 -179.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 7.0 p90 -50.44 97.1 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.165 -0.471 . . . . 70.41 110.879 -179.855 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 58.4 m -163.98 179.72 6.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.198 -0.455 . . . . 74.2 110.838 -179.848 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.66 ' O ' ' CB ' ' A' ' 78' ' ' PHE . 9.5 mt 74.29 -53.33 0.68 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.144 -0.48 . . . . 70.34 110.981 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . 0.66 ' CB ' ' O ' ' A' ' 77' ' ' LEU . 1.6 m-30 147.31 -59.21 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.256 0 CA-C-O 121.705 0.764 . . . . 71.24 110.89 179.938 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.51 ' HD2' ' N ' ' A' ' 78' ' ' PHE . 53.0 Cg_endo -69.77 -174.96 1.01 Allowed 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.636 2.224 . . . . 73.34 112.338 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -176.52 97.1 0.05 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.277 -0.419 . . . . 74.43 110.91 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.7 p -167.14 155.76 9.15 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-O 121.648 0.737 . . . . 70.4 110.838 -179.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.401 ' HB2' ' HD3' ' A' ' 83' ' ' LYS . 53.9 Cg_endo -69.75 -49.27 0.58 Allowed 'Trans proline' 0 C--O 1.231 0.175 0 C-N-CA 122.708 2.272 . . . . 71.11 112.302 -179.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.742 ' CD ' HD22 ' A' ' 237' ' ' LEU . 0.0 OUTLIER -132.38 -172.18 2.83 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.182 -0.463 . . . . 64.45 110.909 179.931 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . 0.428 ' CE2' ' HB3' ' A' ' 162' ' ' PRO . 61.0 m95 -64.68 140.32 58.86 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.255 -0.43 . . . . 73.31 110.915 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.15 -2.29 12.78 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.236 -0.438 . . . . 65.3 111.184 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.6 m -72.52 -178.87 2.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.134 -0.485 . . . . 70.34 110.872 -179.883 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.92 -15.98 18.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.121 -0.49 . . . . 71.12 110.882 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -155.67 143.37 11.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.243 -0.435 . . . . 74.14 111.176 179.871 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 6.5 t -118.92 130.26 73.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.2 -0.455 . . . . 72.25 111.132 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.63 HG22 ' HB3' ' A' ' 125' ' ' ARG . 21.9 p -119.88 165.92 13.98 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.161 -0.472 . . . . 71.01 111.149 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 3.1 p90 -151.45 146.48 25.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.211 -0.449 . . . . 70.51 110.901 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 4.0 ttt180 -149.17 131.68 15.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.142 -0.481 . . . . 71.25 110.852 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.562 HG23 ' O ' ' A' ' 136' ' ' ILE . 5.0 mp -75.27 132.87 32.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.132 -0.485 . . . . 72.4 111.162 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.431 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 22.0 t -84.99 -40.29 14.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.166 -0.47 . . . . 60.2 111.111 179.897 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 84.5 p -159.15 169.41 24.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.15 -0.477 . . . . 64.24 110.889 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 12.6 p90 -123.61 155.15 38.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.126 -0.488 . . . . 72.25 110.932 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 5.3 t -94.12 141.19 28.83 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.144 -0.48 . . . . 64.11 111.16 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.7 -18.7 1.94 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.236 -0.438 . . . . 72.14 110.894 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.25 -36.93 85.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.169 -0.468 . . . . 74.13 110.818 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.704 HD22 HG21 ' A' ' 104' ' ' THR . 1.2 mt -140.15 153.47 69.16 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.54 0.686 . . . . 72.52 110.952 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . 0.567 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.4 Cg_endo -69.81 150.98 68.63 Favored 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.629 2.219 . . . . 73.11 112.324 179.887 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 12.7 t-160 -52.22 -27.89 16.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.164 -0.471 . . . . 74.11 110.919 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.567 HG22 ' HB2' ' A' ' 101' ' ' PRO . 0.0 OUTLIER -75.03 -39.17 43.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.218 -0.446 . . . . 74.02 111.126 -179.992 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . 0.704 HG21 HD22 ' A' ' 100' ' ' LEU . 3.0 m -69.66 -39.11 77.25 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.157 -0.474 . . . . 52.11 111.14 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.777 ' O ' HG13 ' A' ' 109' ' ' VAL . 76.5 t -72.83 -46.22 53.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.187 -0.461 . . . . 71.51 111.11 179.93 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.683 ' O ' HG22 ' A' ' 109' ' ' VAL . 0.3 OUTLIER -60.74 -44.17 97.01 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.147 -0.479 . . . . 63.44 110.814 179.987 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 11.2 ptm180 -70.16 -34.11 72.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.198 -0.456 . . . . 75.02 110.838 -179.856 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.647 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -61.15 -48.26 82.4 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.17 -0.468 . . . . 71.04 110.877 -179.968 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.777 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.5 m -55.4 -41.61 63.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.244 -0.435 . . . . 72.31 111.087 179.846 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.469 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 10.7 t -70.11 -33.51 71.93 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.16 -0.473 . . . . 72.14 110.878 -179.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.43 ' HB3' HD21 ' A' ' 189' ' ' LEU . 0.4 OUTLIER -61.47 -32.86 72.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.105 -0.498 . . . . 74.35 110.957 179.931 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -97.14 -40.47 8.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.196 -0.457 . . . . 74.32 111.144 179.783 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.712 HD12 HD12 ' A' ' 196' ' ' LEU . 0.4 OUTLIER -65.38 -33.88 77.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.206 -0.452 . . . . 72.0 110.956 -180.0 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 36.7 t-20 -67.55 -35.71 79.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.177 -0.465 . . . . 72.34 110.812 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . 0.908 ' HB3' HD23 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -68.25 -33.6 74.67 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.226 -0.443 . . . . 54.12 110.89 179.888 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 6.0 m95 -68.55 -44.91 73.51 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.225 -0.443 . . . . 75.23 110.966 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -73.38 -40.43 48.45 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.695 -0.764 . . . . 73.32 112.532 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.416 ' HG2' ' O ' ' A' ' 115' ' ' MET . 4.5 ptpt -60.76 -16.93 45.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.709 0.29 . . . . 72.42 110.897 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.667 ' HB3' HG23 ' A' ' 231' ' ' ILE . 27.9 mm-40 -98.26 13.51 31.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.205 -0.452 . . . . 75.24 110.902 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.988 HD12 HD12 ' A' ' 122' ' ' LEU . 6.1 pt -147.64 150.31 36.31 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.561 0.696 . . . . 71.34 111.162 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.85 6.75 1.22 Allowed 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.662 2.242 . . . . 72.21 112.326 179.901 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.988 HD12 HD12 ' A' ' 120' ' ' ILE . 10.2 mt -60.2 -160.37 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.259 -0.428 . . . . 73.22 110.882 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -154.31 121.29 5.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.199 -0.455 . . . . 74.12 110.848 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 10.0 m-30 -109.33 148.74 30.55 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.173 -0.467 . . . . 75.54 110.899 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.63 ' HB3' HG22 ' A' ' 90' ' ' THR . 0.1 OUTLIER -130.69 141.73 50.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.146 -0.479 . . . . 75.14 110.827 -179.884 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.522 ' HE3' HG13 ' A' ' 128' ' ' VAL . 0.1 OUTLIER -80.93 147.5 30.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.148 -0.478 . . . . 72.22 110.911 179.928 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . 1.048 HG11 ' HB2' ' A' ' 132' ' ' ALA . 29.9 m -103.08 126.3 57.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.258 -0.428 . . . . 50.13 111.145 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.602 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -142.45 -10.3 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.12 -0.491 . . . . 74.43 111.17 179.854 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' TRP . . . . . 0.602 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -154.87 109.17 2.96 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.132 -0.486 . . . . 71.25 110.905 179.979 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.68 -159.72 14.33 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.722 -0.752 . . . . 62.11 112.457 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.3 p -101.82 156.33 17.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.852 0.358 . . . . 63.25 111.11 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . 1.048 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -111.61 165.26 12.17 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.176 -0.465 . . . . 51.34 111.053 179.915 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.06 -62.54 1.36 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.225 -0.443 . . . . 75.41 110.817 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . 0.435 HD12 ' O ' ' A' ' 90' ' ' THR . 4.6 mp -88.68 122.53 40.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 70.51 111.167 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . 0.431 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 14.3 mmm -100.58 125.79 46.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.149 -0.478 . . . . 72.43 110.829 179.882 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.562 ' O ' HG23 ' A' ' 93' ' ' ILE . 0.9 OUTLIER -105.92 94.97 3.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.165 -0.47 . . . . 70.04 111.113 179.989 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -129.7 167.71 21.43 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.742 -0.742 . . . . 63.34 112.462 179.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' PHE . . . . . 0.563 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 55.3 m-85 -105.1 145.47 30.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.849 0.357 . . . . 74.01 110.913 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.563 ' HB2' ' O ' ' A' ' 138' ' ' PHE . . . 169.72 166.11 0.05 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.12 -0.491 . . . . 71.21 111.102 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.434 ' HB2' ' HB3' ' A' ' 149' ' ' PHE . 0.0 OUTLIER -107.94 174.21 5.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.262 -0.426 . . . . 62.21 110.819 -179.926 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . 0.555 ' H ' ' HA ' ' A' ' 149' ' ' PHE . . . -55.67 -16.44 11.44 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.753 -0.737 . . . . 74.24 112.471 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . 0.531 ' HB2' ' HD2' ' A' ' 149' ' ' PHE . . . -94.12 13.12 24.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.828 0.347 . . . . 75.03 111.113 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . 0.556 ' CB ' ' HB1' ' A' ' 139' ' ' ALA . 3.2 p80 -79.42 -4.48 51.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.202 -0.453 . . . . 71.11 110.867 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 110.77 48.13 0.75 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.69 -0.767 . . . . 45.51 112.46 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -161.79 175.11 12.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.9 0.381 . . . . 72.14 110.818 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 69.9 p -63.81 175.22 1.19 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.154 -0.476 . . . . 51.25 110.862 -179.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 64.52 118.93 0.02 OUTLIER Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.743 0.782 . . . . 73.4 110.876 -179.882 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.72 151.18 69.26 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.654 2.236 . . . . 74.53 112.325 179.901 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 149' ' ' PHE . . . . . 0.555 ' HA ' ' H ' ' A' ' 141' ' ' GLY . 3.6 p90 -54.23 -38.38 65.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.231 -0.44 . . . . 63.52 110.844 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . 0.492 ' CG ' ' O ' ' A' ' 149' ' ' PHE . 2.7 p30 48.72 18.46 0.19 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.166 -0.47 . . . . 63.11 110.858 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . 0.42 ' C ' ' O ' ' A' ' 150' ' ' ASP . . . 36.44 -150.29 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.767 -0.73 . . . . 71.41 112.434 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.72 144.66 54.93 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.709 2.273 . . . . 75.11 112.289 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . 0.449 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 106.04 -138.14 14.18 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.737 -0.744 . . . . 70.32 112.447 179.904 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 154' ' ' ASN . . . . . 0.449 ' C ' ' O ' ' A' ' 153' ' ' GLY . 3.6 p30 -34.2 136.37 0.13 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.882 0.373 . . . . 73.25 110.881 -179.856 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 155' ' ' THR . . . . . 0.419 HG22 ' HA3' ' A' ' 68' ' ' GLY . 0.2 OUTLIER 75.56 110.56 0.07 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.185 -0.461 . . . . 44.41 111.15 179.992 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . 0.932 HD21 HG21 ' A' ' 186' ' ' ILE . 0.4 OUTLIER -91.17 -54.32 3.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.222 -0.445 . . . . 75.02 110.896 -179.979 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . 0.545 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -163.85 148.95 10.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.22 -0.446 . . . . 71.42 111.022 179.794 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 158' ' ' HIS . . . . . 0.415 ' O ' ' HB2' ' A' ' 171' ' ' HIS . 14.5 p-80 -107.54 125.38 51.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.155 -0.475 . . . . 72.02 110.908 179.943 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -110.54 155.09 22.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.229 -0.441 . . . . 74.42 111.1 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 16.7 m-85 -106.86 151.95 24.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.246 -0.434 . . . . 75.31 110.867 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . 0.713 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -78.52 164.75 54.29 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.626 0.727 . . . . 61.04 111.046 179.925 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 162' ' ' PRO . . . . . 0.713 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.2 Cg_endo -69.83 78.48 1.03 Allowed 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.688 2.259 . . . . 74.44 112.257 -179.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 163' ' ' GLY . . . . . 0.478 ' HA3' ' HG3' ' A' ' 79' ' ' PRO . . . -130.45 119.87 2.87 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.73 -0.748 . . . . 61.41 112.422 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 50.85 -169.86 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.874 0.369 . . . . 73.1 111.101 -179.896 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -75.51 -54.57 5.45 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.752 -0.737 . . . . 74.03 112.508 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 166' ' ' LEU . . . . . 0.438 ' C ' HD23 ' A' ' 166' ' ' LEU . 10.1 tt -54.36 -40.15 67.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.863 0.364 . . . . 65.12 110.895 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -80.22 164.04 47.47 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.742 -0.742 . . . . 43.43 112.512 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 168' ' ' GLY . . . . . 0.403 ' O ' HG13 ' A' ' 134' ' ' ILE . . . 84.54 23.11 51.88 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.815 -0.707 . . . . 74.31 112.515 -179.85 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -91.3 163.52 14.19 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.736 0.303 . . . . 63.41 110.89 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.49 130.95 55.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.225 -0.443 . . . . 74.21 111.061 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 171' ' ' HIS . . . . . 0.415 ' HB2' ' O ' ' A' ' 158' ' ' HIS . 27.3 m170 -125.1 158.55 33.58 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 72.53 110.831 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 64.0 m-85 -142.26 137.37 30.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.251 -0.432 . . . . 71.44 110.904 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 55.2 t0 -69.08 99.23 1.07 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 74.11 110.82 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.58 -16.41 10.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.152 -0.476 . . . . 72.25 110.879 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -77.86 -16.32 58.37 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.163 -0.472 . . . . 73.32 110.783 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 23.6 mm-40 -83.38 -175.65 5.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.241 -0.436 . . . . 63.2 110.898 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 1.9 mtt180 -109.8 116.79 32.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.143 -0.481 . . . . 63.14 110.917 -179.888 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 51.0 m95 -116.61 141.18 48.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.253 -0.43 . . . . 72.31 110.919 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 179' ' ' THR . . . . . 0.645 ' HA ' HD11 ' A' ' 100' ' ' LEU . 2.0 t -177.61 164.36 2.02 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.19 -0.459 . . . . 74.13 111.129 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -124.59 -68.76 0.84 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.213 -0.449 . . . . 45.33 110.881 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -70.51 -10.88 67.54 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.712 -0.756 . . . . 62.41 112.501 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 182' ' ' SER . . . . . 0.483 ' O ' ' C ' ' A' ' 183' ' ' SER . 0.2 OUTLIER -97.01 -24.29 15.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.878 0.37 . . . . 64.5 110.84 -179.723 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 183' ' ' SER . . . . . 0.483 ' C ' ' O ' ' A' ' 182' ' ' SER . 7.4 p 31.84 71.56 0.08 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.172 -0.467 . . . . 64.12 110.854 -179.877 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 184' ' ' LEU . . . . . 0.42 HD23 ' CG2' ' A' ' 179' ' ' THR . 0.5 OUTLIER -117.09 -32.64 4.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.215 -0.448 . . . . 74.2 110.895 179.987 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -132.28 -127.23 2.8 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.812 -0.708 . . . . 73.01 112.529 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 186' ' ' ILE . . . . . 0.932 HG21 HD21 ' A' ' 156' ' ' LEU . 6.7 mm -79.53 99.81 3.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.823 0.344 . . . . 73.22 111.147 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -55.96 125.65 22.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.173 -0.467 . . . . 71.31 110.824 179.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 188' ' ' PHE . . . . . 0.722 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.1 t80 -53.85 -33.28 55.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.185 -0.461 . . . . 75.45 110.863 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . 0.43 HD21 ' HB3' ' A' ' 111' ' ' LYS . 0.2 OUTLIER -67.21 -47.62 70.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.193 -0.458 . . . . 52.02 110.907 -179.981 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 10.1 m-30 -69.98 -40.15 75.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.228 -0.442 . . . . 74.22 110.908 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 191' ' ' ALA . . . . . 0.568 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -70.22 -35.8 74.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.119 -0.491 . . . . 50.03 111.061 179.919 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 192' ' ' ALA . . . . . 0.714 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -56.93 -44.66 82.69 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.26 -0.427 . . . . 52.11 111.132 179.914 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 193' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.07 -41.51 83.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.207 -0.451 . . . . 72.43 111.164 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 5.0 t-160 -72.81 -41.73 64.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 71.44 110.844 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -71.56 -48.42 48.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.164 -0.471 . . . . 71.01 111.142 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 196' ' ' LEU . . . . . 0.714 HD23 ' O ' ' A' ' 192' ' ' ALA . 4.3 mm? -64.66 -42.02 95.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.232 -0.44 . . . . 74.51 110.885 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -60.11 -29.04 67.48 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.784 -0.722 . . . . 52.23 112.438 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 198' ' ' HIS . . . . . 0.61 ' CD2' HG21 ' A' ' 69' ' ' VAL . 6.1 m-70 -69.19 -33.95 74.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.876 0.37 . . . . 75.21 110.947 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -68.92 -21.37 64.22 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.179 -0.464 . . . . 71.13 110.818 -179.794 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 200' ' ' LEU . . . . . 0.418 ' HB2' ' HG2' ' A' ' 202' ' ' MET . 0.5 OUTLIER -88.0 -1.05 57.75 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.155 -0.475 . . . . 64.13 110.913 -179.974 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 84.3 8.97 82.75 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.721 -0.752 . . . . 50.41 112.501 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 202' ' ' MET . . . . . 0.657 ' SD ' HD12 ' A' ' 234' ' ' ILE . 97.3 mmm -71.19 159.27 34.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.885 0.374 . . . . 63.21 110.882 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -125.94 159.18 20.34 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.682 -0.77 . . . . 64.44 112.45 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 16.4 m-70 -50.67 161.05 0.37 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.842 0.354 . . . . 74.32 110.873 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -123.16 150.47 43.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.199 -0.455 . . . . 53.34 110.915 -179.832 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 206' ' ' SER . . . . . 0.42 ' HB3' ' HA2' ' A' ' 47' ' ' GLY . 0.9 OUTLIER -87.63 -4.67 58.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.154 -0.475 . . . . 72.22 110.864 -179.817 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.55 137.96 83.41 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 121.557 0.694 . . . . 65.11 110.859 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 -7.23 20.54 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.699 2.266 . . . . 74.53 112.317 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 -128.97 30.78 5.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.24 -0.436 . . . . 63.52 110.9 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 210' ' ' ALA . . . . . . . . . . . . . . . -87.11 145.7 26.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.129 -0.487 . . . . 62.23 111.149 179.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -67.77 -27.72 39.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.231 -0.44 . . . . 62.04 111.109 -179.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 81.1 mtp -97.1 8.58 44.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.167 -0.47 . . . . 75.22 110.906 179.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 213' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -55.89 114.16 6.99 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.695 0.759 . . . . 73.43 110.913 -179.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -69.72 -17.95 37.49 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.658 2.239 . . . . 63.01 112.372 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 215' ' ' THR . . . . . 0.488 HG23 HG21 ' A' ' 61' ' ' ILE . 0.3 OUTLIER -83.98 60.22 5.72 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.2 -0.454 . . . . 74.24 111.103 -179.935 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -47.51 122.75 5.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.968 0.413 . . . . 74.14 110.939 -179.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -131.83 -163.44 10.78 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.795 -0.717 . . . . 74.22 112.53 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 5.5 p30 -98.68 -168.15 1.6 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.905 0.383 . . . . 64.22 110.867 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . 60.04 76.77 0.21 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.742 -0.742 . . . . 72.24 112.507 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 220' ' ' ASP . . . . . . . . . . . . . 7.1 p30 -120.28 153.95 56.02 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-O 121.61 0.719 . . . . 41.43 110.845 -179.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 221' ' ' PRO . . . . . 0.432 ' HG2' ' HB2' ' A' ' 224' ' ' PHE . 53.0 Cg_endo -69.81 168.77 20.66 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.721 2.281 . . . . 73.42 112.337 -179.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.09 -25.69 34.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.258 -0.428 . . . . 74.21 110.885 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 -109.56 -41.67 4.52 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.258 -0.428 . . . . 60.33 110.934 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 224' ' ' PHE . . . . . 0.432 ' HB2' ' HG2' ' A' ' 221' ' ' PRO . 8.1 t80 61.62 132.12 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.142 -0.481 . . . . 65.01 110.861 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.3 -176.87 5.2 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.137 -0.483 . . . . 64.24 110.84 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . 0.908 HD23 ' HB3' ' A' ' 115' ' ' MET . 0.7 OUTLIER -59.7 149.12 31.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.204 -0.453 . . . . 53.44 110.97 179.935 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 227' ' ' SER . . . . . 0.411 ' O ' HD12 ' A' ' 231' ' ' ILE . 2.3 t -86.4 160.43 19.06 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.285 -0.416 . . . . 74.21 110.911 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -63.29 -64.94 0.76 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.134 -0.485 . . . . 74.54 110.925 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -55.58 -26.55 44.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.204 -0.453 . . . . 72.22 110.822 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.36 -48.63 60.69 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.314 -0.403 . . . . 74.23 110.865 -179.934 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 231' ' ' ILE . . . . . 0.667 HG23 ' HB3' ' A' ' 119' ' ' GLU . 7.6 mt -69.06 -42.92 82.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.243 -0.435 . . . . 73.41 111.168 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.57 -32.13 73.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.167 -0.47 . . . . 65.42 110.919 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -63.1 -49.0 75.31 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.749 -0.738 . . . . 63.43 112.472 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 234' ' ' ILE . . . . . 0.657 HD12 ' SD ' ' A' ' 202' ' ' MET . 7.3 tt -72.97 -32.45 39.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.759 0.314 . . . . 71.54 111.11 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -70.12 -24.52 63.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.21 -0.45 . . . . 70.33 110.968 179.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 236' ' ' LYS . . . . . 0.431 ' HE2' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.32 -27.58 60.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.169 -0.469 . . . . 51.21 110.879 -179.991 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 237' ' ' LEU . . . . . 0.742 HD22 ' CD ' ' A' ' 83' ' ' LYS . 3.8 tt -97.78 -26.74 14.61 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.241 -0.436 . . . . 75.41 110.907 179.938 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 238' ' ' TYR . . . . . 0.449 ' OH ' HD11 ' A' ' 122' ' ' LEU . 4.4 m-85 -91.96 -35.2 14.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.194 -0.457 . . . . 51.24 110.985 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -142.85 -119.16 1.41 Allowed Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.794 -0.717 . . . . 32.22 112.499 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 31.8 tttm -87.9 149.74 23.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.749 0.309 . . . . 75.42 110.946 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 6.0 ptm180 -91.19 -173.59 3.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.215 -0.448 . . . . 73.34 110.903 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 40.3 t -146.75 -45.03 0.18 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.273 -0.421 . . . . 62.42 110.866 -179.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -164.55 -176.16 4.2 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.159 -0.473 . . . . 72.13 110.903 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -106.51 117.13 33.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.24 -0.437 . . . . 62.23 110.864 -179.844 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -172.86 -179.66 2.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.184 -0.462 . . . . 70.43 110.871 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 2.5 tttm 59.74 83.04 0.14 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.224 -0.443 . . . . 72.11 110.851 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.232 -0.44 . . . . 74.13 110.826 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 302' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' -2' ' ' LEU . . . . . . . . . . . . . 1.3 mp . . . . . 0 C--O 1.231 0.123 0 CA-C-O 121.618 0.723 . . . . 73.02 110.952 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' -1' ' ' PRO . . . . . 0.513 ' O ' HD12 ' A' ' 0' ' ' LEU . 54.6 Cg_endo -69.8 176.4 6.85 Favored 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.713 2.275 . . . . 71.15 112.35 179.815 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 0' ' ' LEU . . . . . 0.513 HD12 ' O ' ' A' ' -1' ' ' PRO . 0.2 OUTLIER -160.64 160.64 25.57 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.567 0.698 . . . . 62.13 110.92 -179.986 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.75 -170.97 0.43 Allowed 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.713 2.275 . . . . 64.14 112.4 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -118.8 79.43 1.39 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.288 -0.414 . . . . 60.51 110.867 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -95.19 -23.48 17.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.247 -0.433 . . . . 74.01 110.901 -179.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.45 -33.85 66.28 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.149 -0.478 . . . . 71.4 111.158 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -56.15 -34.18 62.14 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.755 -0.736 . . . . 60.51 112.486 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -108.93 21.57 27.19 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.647 -0.787 . . . . 54.22 112.545 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.83 164.13 24.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.784 0.326 . . . . 72.23 110.876 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -83.1 168.69 16.64 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.459 . . . . 73.24 110.852 -179.777 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.431 ' HG3' HD22 ' A' ' 10' ' ' LEU . 15.3 pt-20 -58.84 -32.03 69.05 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.146 -0.479 . . . . 50.12 110.858 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.431 HD22 ' HG3' ' A' ' 9' ' ' GLU . 4.1 mm? -64.19 -42.8 96.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.156 -0.475 . . . . 72.33 110.979 179.973 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -68.53 -38.56 80.96 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.178 -0.465 . . . . 72.14 110.922 179.933 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 50.3 t-105 -73.06 -33.45 65.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 71.22 110.983 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -58.88 -35.62 73.29 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.202 -0.454 . . . . 72.51 110.884 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.09 -36.64 84.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.185 -0.461 . . . . 61.24 110.857 -179.863 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.1 -42.4 80.69 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.251 -0.432 . . . . 54.34 111.138 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.718 ' NE2' HD12 ' A' ' 35' ' ' LEU . 0.0 OUTLIER -73.07 -43.03 62.41 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.187 -0.46 . . . . 73.12 110.927 -179.926 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -61.63 -32.44 72.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.243 -0.435 . . . . 72.4 110.938 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 8.5 m-85 -70.38 -37.07 74.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.15 -0.477 . . . . 75.11 110.953 -179.853 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.617 HD13 ' O ' ' A' ' 19' ' ' LEU . 3.0 tm? -71.73 -24.54 61.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.108 -0.496 . . . . 72.51 110.869 179.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.441 ' HE2' ' HA ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -72.23 -42.36 65.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.238 -0.437 . . . . 74.41 110.918 179.801 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.441 ' HA ' ' HE2' ' A' ' 20' ' ' LYS . 3.2 ptm180 -67.93 -28.19 67.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.19 -0.459 . . . . 74.05 110.887 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.431 ' N ' ' HG3' ' A' ' 21' ' ' ARG . 2.0 m-85 -62.13 -25.09 67.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.199 -0.455 . . . . 74.31 110.86 -179.944 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -120.91 38.36 4.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.143 -0.48 . . . . 72.55 110.92 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.7 mt 70.95 -71.43 0.13 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.086 -0.506 . . . . 75.43 110.887 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -177.41 105.63 0.05 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.22 -0.445 . . . . 71.41 110.924 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -88.32 90.44 8.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.123 -0.49 . . . . 74.25 110.85 179.918 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 24.3 p -85.04 -36.21 21.4 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.151 -0.477 . . . . 62.15 110.917 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -69.9 -14.36 62.69 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.084 -0.507 . . . . 74.51 110.892 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.0 m -90.93 9.55 30.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.197 -0.456 . . . . 70.44 111.179 -179.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.6 108.69 1.02 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.165 -0.471 . . . . 73.33 110.849 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -179.61 153.19 0.54 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.235 -0.439 . . . . 64.43 110.895 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.28 -40.03 59.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.175 -0.466 . . . . 70.21 111.089 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 12.8 m120 -83.24 -25.42 31.68 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.254 -0.43 . . . . 35.31 110.89 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 83.7 p -58.48 -22.24 54.21 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.165 -0.47 . . . . 74.02 110.835 -179.836 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.718 HD12 ' NE2' ' A' ' 16' ' ' GLN . 0.8 OUTLIER -57.89 -43.08 85.88 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.152 -0.476 . . . . 72.52 110.921 179.997 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.473 ' N ' HD23 ' A' ' 35' ' ' LEU . 0.4 OUTLIER -63.63 -53.12 56.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.195 -0.457 . . . . 73.13 110.843 179.944 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -59.35 -49.32 78.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.156 -0.475 . . . . 63.32 111.071 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.556 ' HD3' HD12 ' A' ' 19' ' ' LEU . 33.7 tttt -59.91 -38.79 83.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.225 -0.443 . . . . 72.32 110.92 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.461 HD22 ' HG ' ' A' ' 35' ' ' LEU . 0.8 OUTLIER -67.53 -35.93 80.04 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.267 -0.424 . . . . 72.11 110.931 179.888 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 19.3 mttt -63.14 -45.17 93.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.123 -0.489 . . . . 62.43 110.951 179.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -69.48 -33.32 72.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.191 -0.458 . . . . 75.11 110.903 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.563 ' CE ' HD11 ' A' ' 61' ' ' ILE . 1.9 ttt -66.06 -47.66 73.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.137 -0.483 . . . . 63.43 110.922 179.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.693 ' HA ' HD12 ' A' ' 48' ' ' LEU . 17.4 mt-30 -58.64 -39.65 81.18 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.223 -0.444 . . . . 74.45 110.896 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.8 mmpt? -59.23 -20.57 55.19 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.248 -0.433 . . . . 71.43 110.823 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 68.8 t80 -70.42 -46.3 64.2 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.274 -0.421 . . . . 73.32 110.817 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.625 ' CE1' HD12 ' A' ' 61' ' ' ILE . 36.1 m-85 -81.82 -3.78 54.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.175 -0.466 . . . . 70.43 110.888 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.45 12.49 84.49 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.689 -0.767 . . . . 64.34 112.475 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.693 HD12 ' HA ' ' A' ' 43' ' ' GLN . 0.3 OUTLIER -59.73 140.58 89.45 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.568 0.699 . . . . 64.11 110.941 -179.936 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.8 -53.29 0.28 Allowed 'Trans proline' 0 C--O 1.231 0.159 0 C-N-CA 122.72 2.28 . . . . 74.5 112.318 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.545 HD11 ' HB3' ' A' ' 48' ' ' LEU . 0.8 OUTLIER -53.33 139.25 11.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 71.22 111.032 179.969 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -129.63 126.94 39.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.133 -0.485 . . . . 73.25 111.174 179.877 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 85.07 5.69 85.62 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.735 -0.745 . . . . 64.24 112.509 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -135.05 154.63 51.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.829 0.347 . . . . 75.23 110.864 -179.942 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.428 HD23 ' CD2' ' A' ' 39' ' ' LEU . 2.8 pp -159.16 130.23 6.11 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.203 -0.453 . . . . 73.4 110.955 179.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 173.96 -24.38 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.132 -0.486 . . . . 44.35 110.898 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -104.09 -81.27 0.52 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 75.25 110.912 -179.888 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.672 ' O ' HG23 ' A' ' 61' ' ' ILE . 0.1 OUTLIER -84.3 -45.55 12.71 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.161 -0.472 . . . . 61.22 110.954 179.974 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.525 HG22 HD13 ' A' ' 48' ' ' LEU . 41.3 t -57.14 -45.69 84.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.124 -0.489 . . . . 70.12 111.129 179.94 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.423 HD13 ' HB2' ' A' ' 62' ' ' MET . 0.2 OUTLIER -74.63 -30.45 25.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.163 -0.472 . . . . 74.43 111.105 179.989 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -59.62 -40.47 87.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.174 -0.466 . . . . 73.45 110.832 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.672 HG23 ' O ' ' A' ' 57' ' ' ARG . 0.5 OUTLIER -68.43 -29.43 44.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.156 -0.474 . . . . 74.52 111.115 -179.968 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.423 ' HB2' HD13 ' A' ' 59' ' ' ILE . 6.9 mtt -65.19 -32.68 74.48 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.161 -0.472 . . . . 74.01 110.932 179.775 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -100.66 -26.48 13.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.16 -0.473 . . . . 42.22 110.913 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.35 119.01 71.89 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.52 0.676 . . . . 65.34 110.932 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.71 143.36 50.83 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.706 2.271 . . . . 72.11 112.33 179.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 2.0 ppt_? -155.73 -53.73 0.09 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.192 -0.458 . . . . 71.51 110.882 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 6.4 t -139.42 123.88 18.23 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.163 -0.471 . . . . 55.3 110.928 -179.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.534 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -79.33 -36.91 25.81 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.747 -0.739 . . . . 64.23 112.462 -179.888 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.673 HG21 ' O ' ' A' ' 159' ' ' ALA . 1.1 t -64.71 146.45 98.45 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-O 121.592 0.71 . . . . 74.23 111.209 -179.988 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.515 ' HD2' HG22 ' A' ' 69' ' ' VAL . 52.9 Cg_endo -69.81 159.85 51.84 Favored 'Trans proline' 0 C--O 1.231 0.166 0 C-N-CA 122.675 2.25 . . . . 63.44 112.302 -180.0 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -85.0 -0.29 53.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.219 -0.446 . . . . 74.45 110.876 179.925 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.9 m -103.56 128.56 56.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.199 -0.455 . . . . 53.43 111.095 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -131.13 170.64 14.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.176 -0.466 . . . . 73.13 111.108 179.825 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -130.47 134.64 47.25 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.204 -0.453 . . . . 73.31 110.921 -179.955 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 39.4 p90 -48.92 121.84 5.14 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.213 -0.448 . . . . 70.41 110.839 -179.789 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -56.42 179.1 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.101 -0.5 . . . . 74.2 110.829 -179.862 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -137.31 -61.95 0.63 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.136 -0.484 . . . . 70.34 110.911 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . 0.565 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 0.1 OUTLIER -75.08 -55.94 2.14 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.654 0.74 . . . . 71.24 110.926 179.914 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.565 ' HD2' ' N ' ' A' ' 78' ' ' PHE . 52.9 Cg_endo -69.78 114.94 3.87 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.714 2.276 . . . . 73.34 112.324 -179.974 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 8.0 m-20 -54.71 104.05 0.1 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.216 -0.447 . . . . 74.43 110.911 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 65.03 160.15 0.12 Allowed Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.654 0.74 . . . . 70.4 110.871 -179.839 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 -23.08 31.12 Favored 'Trans proline' 0 C--O 1.232 0.195 0 C-N-CA 122.688 2.259 . . . . 71.11 112.316 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.764 ' HD2' HD13 ' A' ' 237' ' ' LEU . 4.2 mtpt -88.98 150.72 22.68 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.229 -0.441 . . . . 64.45 110.906 179.928 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . 0.414 ' CH2' ' HB3' ' A' ' 162' ' ' PRO . 95.6 m95 -50.96 132.54 27.24 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.324 -0.398 . . . . 73.31 110.935 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -114.48 -10.66 12.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.307 -0.406 . . . . 65.3 111.147 -179.916 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -64.85 -176.77 0.29 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.241 -0.436 . . . . 70.34 110.909 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 9.7 mptt -99.39 -11.14 21.43 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.116 -0.493 . . . . 71.12 110.885 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.459 HG23 ' CD2' ' A' ' 123' ' ' HIS . 0.4 OUTLIER -156.19 142.1 10.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.172 -0.467 . . . . 74.14 111.141 179.877 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 90.5 t -118.46 130.51 73.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.101 -0.499 . . . . 72.25 111.156 179.865 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -115.95 161.57 18.64 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.202 -0.453 . . . . 71.01 111.128 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 4.6 p90 -149.37 147.16 27.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 70.51 110.88 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -150.07 138.86 20.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.103 -0.498 . . . . 71.25 110.96 -179.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.441 HD11 ' HA ' ' A' ' 106' ' ' ASP . 10.0 mm -78.29 133.48 30.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.24 -0.436 . . . . 72.4 111.169 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.485 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 18.8 t -86.91 -40.47 14.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.194 -0.457 . . . . 60.2 111.201 179.825 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 2.9 t -143.67 169.38 17.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.128 -0.487 . . . . 64.24 110.859 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 8.8 p90 -111.62 148.88 32.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.165 -0.47 . . . . 72.25 110.926 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.51 ' OG1' HG21 ' A' ' 105' ' ' VAL . 0.2 OUTLIER -82.91 141.05 32.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.071 -0.513 . . . . 64.11 111.134 -179.986 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 2.8 ppt_? -71.7 -8.76 56.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.209 -0.45 . . . . 72.14 110.799 -179.925 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -96.6 -25.79 15.47 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.199 -0.455 . . . . 74.13 110.876 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.468 ' O ' ' O ' ' A' ' 97' ' ' THR . 1.1 mp -137.68 152.45 72.68 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.618 0.723 . . . . 72.52 110.927 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . 0.599 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.9 Cg_endo -69.73 150.95 69.1 Favored 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 122.701 2.268 . . . . 73.11 112.309 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 4.7 t-160 -52.06 -25.59 9.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.455 . . . . 74.11 110.837 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.599 HG22 ' HB2' ' A' ' 101' ' ' PRO . 11.7 tt -77.26 -37.47 25.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.263 -0.426 . . . . 74.02 111.143 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . 0.795 ' O ' HD22 ' A' ' 108' ' ' LEU . 3.4 m -68.94 -39.19 79.71 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.174 -0.467 . . . . 52.11 111.13 179.941 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.792 ' O ' HG13 ' A' ' 109' ' ' VAL . 81.1 t -71.76 -45.74 64.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.212 -0.449 . . . . 71.51 111.145 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.624 ' O ' HG22 ' A' ' 109' ' ' VAL . 16.0 t0 -62.61 -39.53 94.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.208 -0.451 . . . . 63.44 110.917 179.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . 0.499 ' HG3' ' N ' ' A' ' 108' ' ' LEU . 0.0 OUTLIER -70.57 -33.8 71.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.168 -0.469 . . . . 75.02 110.926 179.996 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.795 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -65.61 -49.56 68.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.202 -0.453 . . . . 71.04 110.934 -179.971 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.792 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.6 m -55.83 -42.93 72.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.183 -0.462 . . . . 72.31 111.059 179.877 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.489 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 44.6 t -70.2 -34.17 72.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.13 -0.487 . . . . 72.14 110.903 -179.824 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.496 ' CG ' HD21 ' A' ' 189' ' ' LEU . 0.4 OUTLIER -62.16 -33.25 74.16 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.105 -0.498 . . . . 74.35 110.942 179.878 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.43 -40.28 9.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.272 -0.422 . . . . 74.32 111.16 179.755 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.852 HD12 HD12 ' A' ' 196' ' ' LEU . 0.4 OUTLIER -65.59 -33.2 75.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 72.0 110.949 179.97 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -69.59 -44.42 70.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.15 -0.477 . . . . 72.34 110.87 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . 0.492 ' O ' HD11 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -57.84 -34.86 70.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.207 -0.452 . . . . 54.12 110.843 179.936 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 5.1 m95 -62.53 -47.44 83.91 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.287 -0.415 . . . . 75.23 110.91 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . 0.482 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -72.97 -32.77 60.41 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.745 -0.741 . . . . 73.32 112.507 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.0 mmpt? -62.98 -14.3 45.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.842 0.353 . . . . 72.42 110.971 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.734 ' HG2' HD13 ' A' ' 226' ' ' LEU . 0.9 OUTLIER -104.65 13.71 31.07 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.112 -0.495 . . . . 75.24 110.906 179.904 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 1.063 HD12 HD12 ' A' ' 122' ' ' LEU . 5.8 pt -146.91 156.29 47.61 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.707 0.765 . . . . 71.34 111.063 -179.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.83 2.14 3.84 Favored 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 122.701 2.267 . . . . 72.21 112.333 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 1.063 HD12 HD12 ' A' ' 120' ' ' ILE . 7.1 mt -60.96 -157.42 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.219 -0.446 . . . . 73.22 110.892 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.459 ' CD2' HG23 ' A' ' 88' ' ' VAL . 5.0 t60 -163.63 138.47 6.15 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.158 -0.474 . . . . 74.12 110.822 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . 0.469 ' CD2' HD21 ' A' ' 113' ' ' LEU . 37.3 m-85 -120.88 148.83 43.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.195 -0.457 . . . . 75.54 110.902 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.4 141.22 51.48 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.204 -0.453 . . . . 75.14 110.877 -179.879 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.51 140.04 36.07 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.219 -0.446 . . . . 72.22 110.84 179.973 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . 0.933 HG11 ' HB2' ' A' ' 132' ' ' ALA . 15.0 m -102.56 131.48 50.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.188 -0.46 . . . . 50.13 111.149 179.871 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.462 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -143.93 -22.33 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 74.43 111.122 179.962 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' TRP . . . . . 0.462 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -138.6 109.19 6.58 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.151 -0.477 . . . . 71.25 110.91 179.992 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.67 -159.59 14.4 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.655 -0.783 . . . . 62.11 112.49 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.87 155.71 17.98 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.788 0.327 . . . . 63.25 111.115 -179.86 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . 0.933 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -112.08 165.19 12.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.209 -0.45 . . . . 51.34 111.128 179.824 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -65.89 -62.61 1.4 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.23 -0.441 . . . . 75.41 110.888 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 53.6 mt -86.59 132.25 32.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.21 -0.45 . . . . 70.51 111.142 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . 0.485 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 18.4 mmm -110.64 123.1 49.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.214 -0.448 . . . . 72.43 110.892 179.846 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.44 ' O ' HG23 ' A' ' 93' ' ' ILE . 0.5 OUTLIER -106.54 92.87 2.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.256 -0.429 . . . . 70.04 111.133 179.983 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . 0.453 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -135.56 162.58 24.91 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.783 -0.722 . . . . 63.34 112.491 179.911 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -105.25 142.53 34.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.856 0.36 . . . . 74.01 110.918 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.486 ' HB1' ' HB3' ' A' ' 143' ' ' HIS . . . 179.74 168.02 1.18 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.199 -0.455 . . . . 71.21 111.107 179.891 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 38.3 mtm180 -103.29 173.43 6.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.226 -0.443 . . . . 62.21 110.899 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -52.8 -19.06 6.31 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.755 -0.736 . . . . 74.24 112.495 -179.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -87.89 13.36 10.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.857 0.36 . . . . 75.03 111.127 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . 0.486 ' HB3' ' HB1' ' A' ' 139' ' ' ALA . 11.0 p80 -77.05 -22.02 53.59 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.17 -0.468 . . . . 71.11 110.823 -179.924 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 138.18 52.67 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.798 -0.715 . . . . 45.51 112.509 -179.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 34.4 p-10 -173.36 156.59 3.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.885 0.374 . . . . 72.14 110.815 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 9.7 m -71.69 173.48 8.07 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.124 -0.489 . . . . 51.25 110.859 -179.781 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 147' ' ' TYR . . . . . 0.434 ' HA ' ' HD2' ' A' ' 148' ' ' PRO . 0.1 OUTLIER 63.1 106.82 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.571 0.7 . . . . 73.4 110.902 -179.887 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . 0.434 ' HD2' ' HA ' ' A' ' 147' ' ' TYR . 54.4 Cg_endo -69.71 143.54 51.41 Favored 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.717 2.278 . . . . 74.53 112.353 179.887 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 149' ' ' PHE . . . . . 0.454 ' CE1' ' HB2' ' A' ' 173' ' ' ASP . 0.1 OUTLIER -64.2 -14.7 57.03 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.247 -0.433 . . . . 63.52 110.931 179.943 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 75.6 -4.11 2.44 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.127 -0.488 . . . . 63.11 110.85 179.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 66.92 -137.96 34.48 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.711 -0.757 . . . . 71.41 112.515 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.72 141.33 45.08 Favored 'Trans proline' 0 C--O 1.231 0.144 0 C-N-CA 122.699 2.266 . . . . 75.11 112.37 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 103.4 -144.9 16.07 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.778 -0.725 . . . . 70.32 112.456 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -39.01 150.19 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.967 0.413 . . . . 73.25 110.88 -179.834 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 155' ' ' THR . . . . . 0.409 ' CG2' ' HA2' ' A' ' 68' ' ' GLY . 0.2 OUTLIER 75.24 103.71 0.07 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.163 -0.471 . . . . 44.41 111.129 -179.956 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . 1.009 HD21 HG21 ' A' ' 186' ' ' ILE . 0.5 OUTLIER -87.08 -54.98 4.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.224 -0.444 . . . . 75.02 110.96 179.911 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . 0.557 ' HB1' ' O ' ' A' ' 171' ' ' HIS . . . -162.11 148.47 13.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.471 . . . . 71.42 111.045 179.76 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 32.0 p-80 -112.28 118.74 36.11 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.143 -0.48 . . . . 72.02 110.821 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.673 ' O ' HG21 ' A' ' 69' ' ' VAL . . . -111.16 150.18 29.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 74.42 111.098 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -120.65 172.83 7.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.183 -0.462 . . . . 75.31 110.904 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . 0.695 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -104.12 164.26 15.67 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.591 0.71 . . . . 61.04 111.133 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 162' ' ' PRO . . . . . 0.695 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.3 Cg_endo -69.8 88.49 0.54 Allowed 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.68 2.254 . . . . 74.44 112.38 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 163' ' ' GLY . . . . . 0.418 ' HA2' ' HG3' ' A' ' 79' ' ' PRO . . . -124.27 120.44 4.07 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.798 -0.715 . . . . 61.41 112.53 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 2.3 m 73.41 -68.33 0.23 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.823 0.344 . . . . 73.1 111.175 -179.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . 176.46 -61.67 0.1 Allowed Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.714 -0.755 . . . . 74.03 112.442 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 166' ' ' LEU . . . . . 0.541 HD23 ' O ' ' A' ' 166' ' ' LEU . 9.7 tt -53.95 -30.99 49.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.854 0.359 . . . . 65.12 110.897 -179.89 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -72.43 -173.87 22.97 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.765 -0.731 . . . . 43.43 112.465 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 73.01 22.93 78.75 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.69 -0.767 . . . . 74.31 112.498 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -100.44 161.6 13.49 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.859 0.362 . . . . 63.41 110.882 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.56 130.76 55.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.204 -0.453 . . . . 74.21 111.024 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 171' ' ' HIS . . . . . 0.557 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 48.3 m170 -127.0 132.74 50.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.181 -0.463 . . . . 72.53 110.862 -180.0 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 38.0 m-85 -116.13 138.86 50.88 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.238 -0.437 . . . . 71.44 110.883 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 173' ' ' ASP . . . . . 0.454 ' HB2' ' CE1' ' A' ' 149' ' ' PHE . 11.1 t0 -64.92 95.19 0.15 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 74.11 110.858 179.983 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 2.9 pp20? -55.64 -18.7 8.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.23 -0.441 . . . . 72.25 110.904 -179.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.82 -22.73 42.68 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.177 -0.465 . . . . 73.32 110.884 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 176' ' ' GLU . . . . . 0.438 ' HG3' HD13 ' A' ' 156' ' ' LEU . 0.0 OUTLIER -72.73 -170.99 0.76 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 63.2 110.89 -179.926 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 177' ' ' ARG . . . . . 0.409 ' HG3' ' HA3' ' A' ' 185' ' ' GLY . 0.5 OUTLIER -116.57 114.37 24.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.166 -0.47 . . . . 63.14 110.909 -179.88 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 48.6 m95 -116.77 142.77 46.49 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.173 -0.467 . . . . 72.31 111.014 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 179' ' ' THR . . . . . 0.511 HG21 ' HB3' ' A' ' 182' ' ' SER . 13.1 t -177.66 163.57 1.91 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.279 -0.419 . . . . 74.13 111.183 -179.942 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -125.0 -68.86 0.82 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.22 -0.445 . . . . 45.33 110.913 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -63.6 -13.13 49.79 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.736 -0.745 . . . . 62.41 112.555 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 182' ' ' SER . . . . . 0.511 ' HB3' HG21 ' A' ' 179' ' ' THR . 0.3 OUTLIER -93.48 -24.39 18.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.917 0.389 . . . . 64.5 110.877 -179.8 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 183' ' ' SER . . . . . 0.402 ' C ' ' O ' ' A' ' 182' ' ' SER . 7.4 p 37.97 43.78 0.56 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.091 -0.504 . . . . 64.12 110.854 -179.809 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 1.2 tt -107.51 -33.39 7.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.104 -0.498 . . . . 74.2 110.91 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 185' ' ' GLY . . . . . 0.409 ' HA3' ' HG3' ' A' ' 177' ' ' ARG . . . -113.42 -145.58 9.3 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.736 -0.745 . . . . 73.01 112.485 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 186' ' ' ILE . . . . . 1.009 HG21 HD21 ' A' ' 156' ' ' LEU . 8.2 mm -79.03 99.54 3.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.893 0.377 . . . . 73.22 111.125 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -44.27 123.85 3.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.466 . . . . 71.31 110.873 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 188' ' ' PHE . . . . . 0.702 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.4 t80 -59.83 -38.45 82.06 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.098 -0.501 . . . . 75.45 110.872 -179.92 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . 0.496 HD21 ' CG ' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -67.34 -47.61 69.97 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.129 -0.487 . . . . 52.02 110.895 179.984 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 65.6 t80 -67.54 -39.86 84.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.248 -0.433 . . . . 74.22 110.931 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 191' ' ' ALA . . . . . 0.566 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -72.5 -35.21 68.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.091 -0.504 . . . . 50.03 111.121 179.903 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 192' ' ' ALA . . . . . 0.686 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -57.37 -44.69 84.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 52.11 111.079 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 193' ' ' THR . . . . . 0.403 HG21 HG21 ' A' ' 211' ' ' VAL . 13.6 m -58.28 -43.41 88.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.225 -0.443 . . . . 72.43 111.137 -179.911 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 34.1 t60 -72.82 -42.97 63.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.2 -0.455 . . . . 71.44 110.863 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -69.87 -47.72 61.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.221 -0.445 . . . . 71.01 111.106 179.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 196' ' ' LEU . . . . . 0.852 HD12 HD12 ' A' ' 113' ' ' LEU . 4.5 mm? -64.62 -33.58 76.28 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.217 -0.447 . . . . 74.51 110.865 -179.942 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -63.58 -26.55 69.85 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.701 -0.761 . . . . 52.23 112.475 179.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 198' ' ' HIS . . . . . . . . . . . . . 4.3 m-70 -67.07 -42.66 84.31 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.825 0.345 . . . . 75.21 110.813 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . 0.416 ' O ' ' HD3' ' A' ' 162' ' ' PRO . 0.1 OUTLIER -61.85 -20.53 63.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.225 -0.443 . . . . 71.13 110.865 -179.755 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 200' ' ' LEU . . . . . 0.423 ' N ' HD23 ' A' ' 200' ' ' LEU . 1.7 mt -86.37 3.2 44.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.091 -0.504 . . . . 64.13 110.872 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 84.1 -9.35 63.79 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.714 -0.755 . . . . 50.41 112.466 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 202' ' ' MET . . . . . . . . . . . . . 42.1 tpp -54.72 153.93 5.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.847 0.356 . . . . 63.21 110.914 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -117.68 177.97 16.79 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.699 -0.762 . . . . 64.44 112.467 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 204' ' ' HIS . . . . . 0.414 ' HA ' ' HB3' ' A' ' 212' ' ' MET . 45.6 m-70 -77.92 149.97 34.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.799 0.333 . . . . 74.32 110.833 -179.955 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 66.2 m -121.86 149.91 42.69 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.18 -0.463 . . . . 53.34 110.835 -179.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 79.1 p -87.79 -4.37 58.88 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.126 -0.488 . . . . 72.22 110.849 -179.796 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 207' ' ' ASP . . . . . 0.42 ' HB2' ' HB2' ' A' ' 210' ' ' ALA . 8.4 m-20 -71.62 130.45 87.23 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.614 0.721 . . . . 65.11 110.858 179.974 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.72 -8.28 23.19 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.688 2.258 . . . . 74.53 112.351 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -116.26 11.09 15.0 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.145 -0.48 . . . . 63.52 110.915 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 210' ' ' ALA . . . . . 0.484 ' HB1' ' CE ' ' A' ' 212' ' ' MET . . . -87.18 146.02 26.18 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.132 -0.486 . . . . 62.23 111.088 179.838 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 211' ' ' VAL . . . . . 0.431 HG12 ' HG3' ' A' ' 212' ' ' MET . 0.4 OUTLIER -70.47 -25.07 26.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.196 -0.456 . . . . 62.04 111.104 179.902 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 212' ' ' MET . . . . . 0.492 ' HE2' ' HB2' ' A' ' 230' ' ' ASP . 0.4 OUTLIER -86.35 3.19 44.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.199 -0.455 . . . . 75.22 110.901 179.937 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 213' ' ' TYR . . . . . 0.44 ' HB2' ' O ' ' A' ' 210' ' ' ALA . 2.0 t80 -54.85 110.23 2.05 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-O 121.636 0.731 . . . . 73.43 110.887 -179.88 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.77 -18.55 36.89 Favored 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.705 2.27 . . . . 63.01 112.41 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 215' ' ' THR . . . . . 0.402 ' HB ' ' CE2' ' A' ' 213' ' ' TYR . 0.2 OUTLIER -84.27 53.6 2.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.184 -0.462 . . . . 74.24 111.116 -179.959 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -65.13 123.81 20.5 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.26 -0.427 . . . . 74.14 110.914 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . 168.42 39.42 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.774 -0.727 . . . . 74.22 112.529 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -113.82 -37.63 4.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.865 0.364 . . . . 64.22 110.91 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . 171.24 166.05 29.47 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.701 -0.761 . . . . 72.24 112.472 179.925 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 220' ' ' ASP . . . . . 0.423 ' HA ' ' HD2' ' A' ' 221' ' ' PRO . 2.7 m-20 -103.0 101.41 21.24 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.552 0.692 . . . . 41.43 110.912 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 221' ' ' PRO . . . . . 0.423 ' HD2' ' HA ' ' A' ' 220' ' ' ASP . 53.7 Cg_endo -69.78 115.44 4.1 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.633 2.222 . . . . 73.42 112.369 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -71.46 -18.25 62.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.203 -0.453 . . . . 74.21 110.92 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 -116.14 -36.2 4.15 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.219 -0.446 . . . . 60.33 110.887 -179.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 224' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER 66.03 143.21 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.143 -0.48 . . . . 65.01 110.841 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.37 147.89 35.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.11 -0.495 . . . . 64.24 110.917 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . 0.734 HD13 ' HG2' ' A' ' 119' ' ' GLU . 10.1 mt -75.45 148.92 38.68 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.203 -0.453 . . . . 53.44 110.924 179.973 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 227' ' ' SER . . . . . 0.427 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 2.1 t -87.2 155.3 20.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.241 -0.436 . . . . 74.21 110.84 -179.926 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -64.11 -66.25 0.57 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.099 -0.5 . . . . 74.54 110.957 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -55.69 -25.62 40.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.181 -0.463 . . . . 72.22 110.904 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 230' ' ' ASP . . . . . 0.492 ' HB2' ' HE2' ' A' ' 212' ' ' MET . 1.3 t70 -68.84 -48.45 63.45 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.169 -0.469 . . . . 74.23 110.855 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 231' ' ' ILE . . . . . 0.634 HG23 ' HB3' ' A' ' 119' ' ' GLU . 12.0 mt -68.21 -42.26 84.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.231 -0.44 . . . . 73.41 111.067 180.0 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 15.2 pttm -65.9 -32.14 73.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.199 -0.455 . . . . 65.42 110.929 179.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -62.62 -46.63 93.34 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.756 -0.735 . . . . 63.43 112.472 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 12.2 tt -72.93 -30.54 32.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.779 0.323 . . . . 71.54 111.101 -179.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -70.96 -24.71 62.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.174 -0.466 . . . . 70.33 110.879 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 236' ' ' LYS . . . . . 0.428 ' HE2' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.1 -26.82 60.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.218 -0.446 . . . . 51.21 110.903 179.969 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 237' ' ' LEU . . . . . 0.764 HD13 ' HD2' ' A' ' 83' ' ' LYS . 10.3 tt -97.25 -24.54 15.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.224 -0.443 . . . . 75.41 110.937 179.878 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 238' ' ' TYR . . . . . 0.625 ' CZ ' HD11 ' A' ' 122' ' ' LEU . 6.3 m-85 -92.36 -35.07 13.92 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.228 -0.442 . . . . 51.24 110.913 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -129.56 -120.08 2.21 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.791 -0.718 . . . . 32.22 112.524 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.41 135.1 33.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.777 0.322 . . . . 75.42 110.883 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.43 176.7 5.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.268 -0.424 . . . . 73.34 110.867 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 1.9 t -161.46 -53.23 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.194 -0.457 . . . . 62.42 110.835 -179.796 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -177.94 110.91 0.07 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.122 -0.49 . . . . 72.13 110.906 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 7.6 p -165.93 175.86 8.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.194 -0.457 . . . . 62.23 110.912 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.6 -169.9 2.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.097 -0.501 . . . . 70.43 110.895 -179.952 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.09 -170.17 3.56 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.206 -0.452 . . . . 72.11 110.843 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 6.8 mmmt . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.186 -0.461 . . . . 74.13 110.864 179.842 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 302' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' -2' ' ' LEU . . . . . 0.481 ' N ' ' HD2' ' A' ' -1' ' ' PRO . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.123 0 CA-C-O 121.551 0.691 . . . . 73.02 110.915 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' -1' ' ' PRO . . . . . 0.481 ' HD2' ' N ' ' A' ' -2' ' ' LEU . 52.9 Cg_endo -69.85 -172.1 0.55 Allowed 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.711 2.274 . . . . 71.15 112.308 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -138.89 160.57 62.37 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.572 0.701 . . . . 62.13 110.935 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.67 130.17 18.98 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.727 2.285 . . . . 64.14 112.409 179.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -147.6 -42.15 0.17 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.298 -0.41 . . . . 60.51 110.851 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -61.07 -18.58 58.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.259 -0.428 . . . . 74.01 110.869 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.512 ' HB1' ' HE2' ' A' ' 7' ' ' MET . . . -56.35 -33.95 66.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.181 -0.463 . . . . 71.4 111.115 179.916 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -55.82 -33.93 60.58 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.756 -0.735 . . . . 60.51 112.539 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -108.94 20.31 29.12 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.818 -0.706 . . . . 54.22 112.48 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . 0.512 ' HE2' ' HB1' ' A' ' 4' ' ' ALA . 15.9 ptp -59.75 164.1 3.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.823 0.344 . . . . 72.23 110.876 -179.998 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -73.01 154.64 40.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.282 -0.417 . . . . 73.24 110.856 -179.801 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -54.4 -31.94 56.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.126 -0.488 . . . . 50.12 110.879 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.55 -42.7 86.74 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.147 -0.479 . . . . 72.33 110.931 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 45.1 mm-40 -62.67 -45.26 93.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.204 -0.453 . . . . 72.14 110.907 179.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 11.6 t-105 -73.15 -31.16 64.09 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.195 -0.457 . . . . 71.22 110.954 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -73.28 -35.37 66.15 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.217 -0.447 . . . . 72.51 110.861 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -62.96 -36.92 85.06 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.229 -0.441 . . . . 61.24 110.92 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.632 ' CB ' HD21 ' A' ' 54' ' ' LEU . . . -59.16 -41.2 87.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 54.34 111.078 179.889 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -72.92 -42.99 62.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.245 -0.434 . . . . 73.12 110.911 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -65.86 -31.82 72.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.219 -0.446 . . . . 72.4 110.847 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -70.33 -35.86 73.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.172 -0.467 . . . . 75.11 110.85 -179.725 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.682 HD13 ' HG2' ' A' ' 38' ' ' LYS . 1.9 mt -71.06 -21.03 62.3 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.157 -0.474 . . . . 72.51 110.952 179.925 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.0 ptmt -75.35 -29.88 60.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.128 -0.487 . . . . 74.41 110.856 179.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.7 ptp180 -86.2 -27.22 24.65 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.259 -0.428 . . . . 74.05 110.839 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -59.62 -21.24 60.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.207 -0.451 . . . . 74.31 110.885 -179.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.439 ' CE2' HD22 ' A' ' 19' ' ' LEU . 5.8 m-85 -120.94 46.2 2.08 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.164 -0.471 . . . . 72.55 110.939 -179.89 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.4 mt 64.23 -168.62 0.2 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.153 -0.476 . . . . 75.43 110.903 179.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -90.79 89.72 7.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 71.41 110.963 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -117.16 112.63 21.11 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.115 -0.493 . . . . 74.25 110.807 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -85.12 -6.41 59.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.158 -0.474 . . . . 62.15 110.853 -179.812 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -67.25 -11.67 58.09 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.187 -0.46 . . . . 74.51 110.882 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.572 HG21 ' HD2' ' A' ' 38' ' ' LYS . 2.4 m -85.66 8.6 18.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.15 -0.477 . . . . 70.44 111.188 -179.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 10.9 ttpt -51.46 170.23 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.187 -0.46 . . . . 73.33 110.939 179.881 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 6.6 m120 66.3 149.15 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.238 -0.437 . . . . 64.43 110.899 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.11 -22.77 58.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.214 -0.448 . . . . 70.21 111.054 179.914 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -57.83 -22.1 45.85 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.237 -0.438 . . . . 35.31 110.878 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 68.8 m -86.73 -19.47 29.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.213 -0.449 . . . . 74.02 110.857 -179.899 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.437 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 8.6 tt -57.52 -45.23 85.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.105 -0.498 . . . . 72.52 110.885 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.44 -51.25 70.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.204 -0.453 . . . . 73.13 110.894 179.918 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -66.04 -36.6 83.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.171 -0.468 . . . . 63.32 111.126 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.682 ' HG2' HD13 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -65.59 -49.08 70.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.447 . . . . 72.32 110.912 179.934 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.439 ' CD2' HD12 ' A' ' 19' ' ' LEU . 4.6 mt -63.19 -35.38 80.11 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.156 -0.475 . . . . 72.11 110.914 179.924 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.8 tttt -68.48 -45.73 71.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.249 -0.432 . . . . 62.43 110.876 179.83 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.547 ' HG3' ' N ' ' A' ' 42' ' ' MET . 0.0 OUTLIER -59.93 -31.87 70.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.193 -0.458 . . . . 75.11 110.946 179.949 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.726 ' CE ' HD11 ' A' ' 61' ' ' ILE . 38.2 ttp -68.5 -34.09 75.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.142 -0.481 . . . . 63.43 110.901 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.458 ' OE1' HD11 ' A' ' 48' ' ' LEU . 1.2 mm-40 -60.65 -39.44 88.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.209 -0.45 . . . . 74.45 110.92 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.1 mmpt? -68.37 -28.36 67.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.47 . . . . 71.43 110.874 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 28.1 t80 -70.28 -45.01 67.2 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.18 -0.464 . . . . 73.32 110.86 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.588 ' CZ ' HD12 ' A' ' 61' ' ' ILE . 17.2 m-85 -81.98 -35.12 29.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.174 -0.466 . . . . 70.43 110.913 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 102.73 -7.13 52.9 Favored Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.75 -0.738 . . . . 64.34 112.466 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.474 HD23 ' CB ' ' A' ' 46' ' ' PHE . 0.8 OUTLIER -59.82 138.78 90.33 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.565 0.697 . . . . 64.11 110.968 -179.975 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.519 ' O ' HG23 ' A' ' 51' ' ' THR . 53.9 Cg_endo -69.73 -53.01 0.29 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.651 2.234 . . . . 74.5 112.374 179.886 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.664 HD12 HG23 ' A' ' 58' ' ' VAL . 0.9 OUTLIER -51.32 108.22 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.215 -0.448 . . . . 71.22 111.126 179.881 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.519 HG23 ' O ' ' A' ' 49' ' ' PRO . 41.4 p -109.0 164.37 12.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.178 -0.464 . . . . 73.25 111.118 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 59.56 17.65 41.62 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.723 -0.751 . . . . 64.24 112.475 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -114.57 161.05 18.56 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.857 0.361 . . . . 75.23 110.837 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.632 HD21 ' CB ' ' A' ' 15' ' ' ALA . 26.8 tp -168.56 84.99 0.17 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.206 -0.452 . . . . 73.4 110.903 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.418 ' HA ' HG13 ' A' ' 59' ' ' ILE . 3.4 p30 175.55 -29.24 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.148 -0.478 . . . . 44.35 110.91 179.914 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 28.5 t -90.84 -100.52 0.1 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.156 -0.474 . . . . 75.25 110.902 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.587 ' O ' HG23 ' A' ' 61' ' ' ILE . 10.7 tpt180 -85.05 -28.89 25.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.155 -0.475 . . . . 61.22 110.884 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.664 HG23 HD12 ' A' ' 50' ' ' ILE . 66.6 t -64.98 -41.56 92.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.188 -0.46 . . . . 70.12 111.103 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.425 HD11 ' HB2' ' A' ' 15' ' ' ALA . 1.0 OUTLIER -74.59 -31.45 27.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.206 -0.452 . . . . 74.43 111.164 179.895 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.03 -33.09 70.34 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.121 -0.49 . . . . 73.45 110.91 179.925 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.726 HD11 ' CE ' ' A' ' 42' ' ' MET . 0.4 OUTLIER -76.45 -29.56 18.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.125 -0.489 . . . . 74.52 111.093 -179.975 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.417 ' HE3' ' HB1' ' A' ' 15' ' ' ALA . 5.2 mmt -64.41 -37.35 87.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.144 -0.48 . . . . 74.01 110.88 179.891 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -86.58 -23.29 25.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.26 -0.427 . . . . 42.22 110.918 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -85.08 124.97 71.58 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.588 0.709 . . . . 65.34 110.842 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 160.49 49.51 Favored 'Trans proline' 0 C--O 1.233 0.254 0 C-N-CA 122.683 2.255 . . . . 72.11 112.406 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -155.53 -77.46 0.1 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.31 -0.405 . . . . 71.51 110.914 -179.957 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -145.18 155.18 43.13 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.119 -0.491 . . . . 55.3 110.843 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.561 ' HA2' HG23 ' A' ' 155' ' ' THR . . . -97.53 11.81 64.86 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.727 -0.749 . . . . 64.23 112.534 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.652 HG21 ' CD2' ' A' ' 198' ' ' HIS . 0.9 OUTLIER -92.37 136.47 25.51 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.703 0.763 . . . . 74.23 111.139 -179.958 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.507 ' HD2' HG12 ' A' ' 69' ' ' VAL . 54.1 Cg_endo -69.75 155.1 66.87 Favored 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.691 2.26 . . . . 63.44 112.338 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -92.66 15.49 14.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.224 -0.444 . . . . 74.45 110.88 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -122.76 129.06 75.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.183 -0.462 . . . . 53.43 111.108 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -131.1 170.66 14.23 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.194 -0.457 . . . . 73.13 111.119 179.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -136.74 142.46 43.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.215 -0.448 . . . . 73.31 110.868 -179.839 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 39.3 p90 -49.23 121.34 4.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.181 -0.463 . . . . 70.41 110.874 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.56 179.31 0.17 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.151 -0.477 . . . . 74.2 110.832 -179.899 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -142.9 -53.79 0.4 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.127 -0.488 . . . . 70.34 110.938 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . 0.475 ' CB ' ' CD ' ' A' ' 79' ' ' PRO . 1.7 m-85 -70.87 -61.53 2.36 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.671 0.748 . . . . 71.24 110.818 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.475 ' CD ' ' CB ' ' A' ' 78' ' ' PHE . 53.5 Cg_endo -69.8 145.53 57.19 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.671 2.247 . . . . 73.34 112.336 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 33.3 m120 -88.38 129.38 35.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.223 -0.444 . . . . 74.43 110.914 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 64.2 153.7 0.12 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.647 0.737 . . . . 70.4 110.892 -179.845 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 -50.46 0.46 Allowed 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.75 2.3 . . . . 71.11 112.378 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.748 ' HD2' HD22 ' A' ' 237' ' ' LEU . 2.6 mttm -84.08 161.74 20.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.157 -0.474 . . . . 64.45 110.895 179.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . 0.751 ' CE3' HG21 ' A' ' 89' ' ' VAL . 40.6 m0 -49.63 123.48 7.87 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.158 -0.474 . . . . 73.31 110.983 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 9.9 t -115.19 -19.43 10.82 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.241 -0.436 . . . . 65.3 111.128 -179.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -53.46 160.98 1.08 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.216 -0.447 . . . . 70.34 110.832 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 2.8 ptmt -74.03 -30.61 62.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.064 -0.516 . . . . 71.12 110.892 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.54 HG23 ' CD2' ' A' ' 123' ' ' HIS . 0.7 OUTLIER -152.72 144.54 15.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.235 -0.439 . . . . 74.14 111.105 179.938 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.751 HG21 ' CE3' ' A' ' 84' ' ' TRP . 12.2 t -130.77 140.95 47.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.22 -0.445 . . . . 72.25 111.101 179.852 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.764 HG22 ' HB3' ' A' ' 125' ' ' ARG . 11.0 p -117.18 167.94 10.74 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.088 -0.505 . . . . 71.01 111.128 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.435 ' HB3' ' HB ' ' A' ' 134' ' ' ILE . 4.9 p90 -150.35 146.55 26.8 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.198 -0.456 . . . . 70.51 110.961 -179.856 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 4.5 ttt-85 -146.29 136.24 23.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.165 -0.471 . . . . 71.25 110.854 -179.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.447 HD11 ' HA ' ' A' ' 106' ' ' ASP . 3.4 mp -74.76 135.54 27.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.169 -0.469 . . . . 72.4 111.195 179.903 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.405 ' CG2' ' HB3' ' A' ' 135' ' ' MET . 19.3 t -89.15 -40.7 13.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.2 -0.454 . . . . 60.2 111.112 179.914 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 5.6 t -144.56 163.4 34.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.208 -0.451 . . . . 64.24 110.857 -179.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 11.2 p90 -110.58 152.47 26.39 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.138 -0.483 . . . . 72.25 110.921 -179.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.474 ' OG1' HG21 ' A' ' 105' ' ' VAL . 0.2 OUTLIER -82.68 140.99 32.8 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.117 -0.492 . . . . 64.11 111.173 -179.989 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.92 -7.8 52.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.197 -0.456 . . . . 72.14 110.923 179.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -96.42 -26.1 15.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.251 -0.431 . . . . 74.13 110.889 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.508 HD11 ' HA ' ' A' ' 179' ' ' THR . 0.9 OUTLIER -133.54 153.6 80.38 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.591 0.71 . . . . 72.52 111.006 -179.956 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . 0.569 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.9 Cg_endo -69.71 150.89 69.13 Favored 'Trans proline' 0 C--O 1.231 0.159 0 C-N-CA 122.703 2.269 . . . . 73.11 112.365 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 15.9 t-160 -52.74 -27.38 17.46 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.221 -0.445 . . . . 74.11 110.866 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.569 HG22 ' HB2' ' A' ' 101' ' ' PRO . 0.0 OUTLIER -75.72 -39.43 39.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.18 -0.463 . . . . 74.02 111.109 -179.956 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . 0.681 ' O ' HD22 ' A' ' 108' ' ' LEU . 3.1 m -69.33 -39.13 78.37 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.114 -0.493 . . . . 52.11 111.154 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.689 ' O ' HG13 ' A' ' 109' ' ' VAL . 92.0 t -72.61 -44.83 60.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.224 -0.444 . . . . 71.51 111.119 179.904 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.635 ' O ' HG22 ' A' ' 109' ' ' VAL . 3.9 t0 -66.25 -41.91 89.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.215 -0.448 . . . . 63.44 110.841 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 6.6 ptm180 -69.9 -33.8 72.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 75.02 110.829 -179.839 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.681 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -60.73 -48.95 79.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.196 -0.456 . . . . 71.04 110.882 -179.96 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.689 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.3 m -55.61 -41.96 66.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.181 -0.463 . . . . 72.31 111.112 179.893 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.469 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 42.7 t -69.97 -34.1 72.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.142 -0.481 . . . . 72.14 110.874 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.453 ' CG ' HD21 ' A' ' 189' ' ' LEU . 0.4 OUTLIER -62.46 -33.33 74.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.111 -0.495 . . . . 74.35 110.882 179.964 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -94.02 -40.97 9.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.288 -0.415 . . . . 74.32 111.12 179.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.75 ' CD1' HD12 ' A' ' 196' ' ' LEU . 0.5 OUTLIER -65.47 -32.91 74.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.179 -0.464 . . . . 72.0 110.969 179.937 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -67.9 -38.06 82.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.226 -0.443 . . . . 72.34 110.946 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . 0.657 ' O ' HD11 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -62.41 -34.62 77.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.083 -0.508 . . . . 54.12 110.881 179.871 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' TRP . . . . . 0.41 ' CZ3' ' SD ' ' A' ' 202' ' ' MET . 8.4 m95 -65.98 -52.29 50.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.198 -0.455 . . . . 75.23 110.929 -179.968 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -63.94 -37.22 94.31 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.728 -0.749 . . . . 73.32 112.453 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.41 -16.31 45.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.758 0.313 . . . . 72.42 110.888 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.65 ' HG3' HG21 ' A' ' 231' ' ' ILE . 0.2 OUTLIER -101.2 12.13 38.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.278 -0.419 . . . . 75.24 110.938 179.938 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.879 HD12 HD12 ' A' ' 122' ' ' LEU . 5.1 pt -149.7 149.36 28.07 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.59 0.709 . . . . 71.34 111.113 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.72 25.71 0.17 Allowed 'Trans proline' 0 C--O 1.231 0.166 0 C-N-CA 122.668 2.245 . . . . 72.21 112.354 179.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.879 HD12 HD12 ' A' ' 120' ' ' ILE . 9.9 mt -80.43 -157.53 0.15 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.193 -0.458 . . . . 73.22 110.908 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.54 ' CD2' HG23 ' A' ' 88' ' ' VAL . 4.2 t60 -163.78 133.59 4.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 74.12 110.855 179.868 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 23.4 m-30 -119.59 142.58 48.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.242 -0.436 . . . . 75.54 110.899 -179.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.764 ' HB3' HG22 ' A' ' 90' ' ' THR . 0.1 OUTLIER -118.85 141.92 48.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.157 -0.474 . . . . 75.14 110.916 -179.991 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.506 ' HE3' HG13 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -80.42 149.48 30.13 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.133 -0.485 . . . . 72.22 110.896 179.996 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . 1.024 HG11 ' HB2' ' A' ' 132' ' ' ALA . 27.4 m -103.21 126.5 57.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.267 -0.424 . . . . 50.13 111.086 179.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.587 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -143.55 -11.79 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.237 -0.438 . . . . 74.43 111.18 179.872 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' TRP . . . . . 0.587 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -153.78 109.22 3.2 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.178 -0.464 . . . . 71.25 110.931 179.967 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.59 -161.2 13.69 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.745 -0.74 . . . . 62.11 112.445 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -101.82 155.97 17.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.767 0.317 . . . . 63.25 111.117 -179.818 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . 1.024 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -111.93 165.3 12.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 51.34 111.132 179.84 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -75.9 -62.02 1.73 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.202 -0.454 . . . . 75.41 110.869 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . 0.635 HD12 ' N ' ' A' ' 134' ' ' ILE . 1.3 mp -82.57 107.5 14.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.254 -0.43 . . . . 70.51 111.117 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . 0.405 ' HB3' ' CG2' ' A' ' 94' ' ' VAL . 11.1 mmm -92.94 131.78 37.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.221 -0.445 . . . . 72.43 110.876 179.797 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.589 ' CD1' HG22 ' A' ' 134' ' ' ILE . 0.3 OUTLIER -113.34 95.33 3.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.251 -0.432 . . . . 70.04 111.141 179.956 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -136.1 165.51 24.88 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.796 -0.716 . . . . 63.34 112.499 179.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' PHE . . . . . 0.543 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 43.5 m-85 -106.42 149.68 26.79 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.859 0.361 . . . . 74.01 110.861 -179.816 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.543 ' HB2' ' O ' ' A' ' 138' ' ' PHE . . . 170.49 166.42 0.07 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.138 -0.483 . . . . 71.21 111.113 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -104.6 173.53 6.26 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.213 -0.449 . . . . 62.21 110.87 -179.916 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -55.13 -17.45 10.54 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.797 -0.716 . . . . 74.24 112.454 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -87.33 12.97 10.68 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.795 0.331 . . . . 75.03 111.086 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 6.1 p80 -81.44 -4.38 55.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.235 -0.438 . . . . 71.11 110.788 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 124.68 7.31 6.23 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.778 -0.725 . . . . 45.51 112.521 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 29.1 m-20 -111.19 163.64 13.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.856 0.36 . . . . 72.14 110.854 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -87.44 176.89 7.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.173 -0.467 . . . . 51.25 110.854 -179.74 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 66.46 127.98 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.687 0.755 . . . . 73.4 110.933 -179.921 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.87 145.42 56.45 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.677 2.251 . . . . 74.53 112.332 179.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 149' ' ' PHE . . . . . 0.403 ' CE1' ' HB2' ' A' ' 173' ' ' ASP . 0.1 OUTLIER -90.87 -31.61 16.37 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.186 -0.461 . . . . 63.52 110.894 -179.985 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 74.39 -1.67 3.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.145 -0.48 . . . . 63.11 110.855 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . 0.638 ' O ' 'CA ' ' A' ' 302' ' ' ' CA' . . . 50.04 -108.52 0.5 Allowed Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.721 -0.752 . . . . 71.41 112.48 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -69.71 139.41 40.33 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.707 2.271 . . . . 75.11 112.401 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 103.29 -153.76 18.06 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.712 -0.756 . . . . 70.32 112.484 179.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 154' ' ' ASN . . . . . 0.412 ' O ' ' CB ' ' A' ' 155' ' ' THR . 4.4 p30 -42.77 155.06 0.06 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.904 0.383 . . . . 73.25 110.872 -179.883 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 155' ' ' THR . . . . . 0.561 HG23 ' HA2' ' A' ' 68' ' ' GLY . 0.2 OUTLIER 78.44 114.01 0.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.152 -0.476 . . . . 44.41 111.182 -179.95 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . 1.05 HD21 HG21 ' A' ' 186' ' ' ILE . 1.1 tp -101.49 -51.79 3.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.22 -0.446 . . . . 75.02 110.94 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . 0.533 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -159.65 148.46 17.74 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.11 -0.495 . . . . 71.42 111.113 179.812 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 37.0 p-80 -110.32 123.2 49.39 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.215 -0.448 . . . . 72.02 110.868 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.55 ' H ' HG22 ' A' ' 69' ' ' VAL . . . -110.36 160.17 16.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.263 -0.426 . . . . 74.42 111.115 179.944 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 16.6 m-30 -118.91 163.32 17.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.205 -0.452 . . . . 75.31 110.852 -179.894 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . 0.725 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -88.09 165.02 31.22 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.543 0.687 . . . . 61.04 111.127 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 162' ' ' PRO . . . . . 0.725 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.6 Cg_endo -69.76 71.61 1.51 Allowed 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.629 2.219 . . . . 74.44 112.377 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -127.91 108.82 0.97 Allowed Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.77 -0.729 . . . . 61.41 112.491 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 1.4 p 59.23 173.74 0.07 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.79 0.329 . . . . 73.1 111.104 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -55.59 -33.74 59.56 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.667 -0.778 . . . . 74.03 112.514 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -71.28 -18.03 62.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.83 0.348 . . . . 65.12 110.89 -179.929 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -88.93 167.29 34.56 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.762 -0.732 . . . . 43.43 112.559 179.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 168' ' ' GLY . . . . . 0.445 ' O ' HG13 ' A' ' 134' ' ' ILE . . . 72.95 15.83 78.36 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.772 -0.728 . . . . 74.31 112.468 -179.893 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -85.76 141.36 29.74 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.823 0.344 . . . . 63.41 110.876 -179.957 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -111.8 130.14 55.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.24 -0.436 . . . . 74.21 111.126 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 171' ' ' HIS . . . . . 0.521 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 49.6 m170 -131.24 132.49 44.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.215 -0.448 . . . . 72.53 110.927 -179.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 31.8 m-85 -111.52 138.02 48.59 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.208 -0.451 . . . . 71.44 110.859 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 173' ' ' ASP . . . . . 0.403 ' HB2' ' CE1' ' A' ' 149' ' ' PHE . 65.7 t0 -65.28 96.02 0.21 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.193 -0.458 . . . . 74.11 110.82 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.66 -16.16 9.83 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.234 -0.439 . . . . 72.25 110.911 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -79.01 -16.35 57.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.122 -0.49 . . . . 73.32 110.831 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 23.7 mm-40 -84.61 -171.48 3.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.22 -0.445 . . . . 63.2 110.956 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 177' ' ' ARG . . . . . 0.43 ' HG3' ' HA3' ' A' ' 185' ' ' GLY . 0.0 OUTLIER -115.91 118.66 33.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.156 -0.474 . . . . 63.14 110.854 -179.941 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 178' ' ' TRP . . . . . 0.401 ' CE3' ' HB ' ' A' ' 186' ' ' ILE . 45.8 m95 -117.01 144.3 44.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.145 -0.479 . . . . 72.31 110.909 -179.95 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 179' ' ' THR . . . . . 0.508 ' HA ' HD11 ' A' ' 100' ' ' LEU . 12.3 t -178.04 163.65 1.76 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.211 -0.449 . . . . 74.13 111.132 -179.936 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -125.25 -69.7 0.78 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.274 -0.421 . . . . 45.33 110.885 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -63.2 -13.24 48.27 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.788 -0.72 . . . . 62.41 112.478 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 182' ' ' SER . . . . . 0.491 ' HB3' HG21 ' A' ' 179' ' ' THR . 0.3 OUTLIER -93.14 -24.31 18.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.939 0.399 . . . . 64.5 110.85 -179.788 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 86.6 p 37.93 43.74 0.55 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 64.12 110.888 -179.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -107.84 -33.54 7.21 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.071 -0.513 . . . . 74.2 110.919 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 185' ' ' GLY . . . . . 0.43 ' HA3' ' HG3' ' A' ' 177' ' ' ARG . . . -112.67 -145.11 9.44 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.711 -0.756 . . . . 73.01 112.525 179.872 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 186' ' ' ILE . . . . . 1.05 HG21 HD21 ' A' ' 156' ' ' LEU . 11.5 mm -78.87 97.8 2.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.9 0.381 . . . . 73.22 111.121 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 22.1 m-80 -44.55 118.17 1.49 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.216 -0.447 . . . . 71.31 110.884 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 188' ' ' PHE . . . . . 0.632 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.4 t80 -53.96 -36.37 62.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.145 -0.479 . . . . 75.45 110.877 179.998 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . 0.453 HD21 ' CG ' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -67.18 -47.16 71.76 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.164 -0.471 . . . . 52.02 110.898 -179.932 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 6.2 t80 -69.24 -38.93 78.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.186 -0.461 . . . . 74.22 110.92 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 191' ' ' ALA . . . . . 0.615 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -72.01 -35.83 69.53 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.125 -0.489 . . . . 50.03 111.134 179.837 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 192' ' ' ALA . . . . . 0.615 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -56.98 -45.0 83.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.195 -0.457 . . . . 52.11 111.078 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 193' ' ' THR . . . . . 0.594 HG21 ' HE1' ' A' ' 224' ' ' PHE . 0.3 OUTLIER -58.52 -41.25 85.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.217 -0.447 . . . . 72.43 111.153 -179.919 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 13.7 t-160 -72.77 -45.41 58.72 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.18 -0.464 . . . . 71.44 110.877 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -69.42 -47.41 64.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.206 -0.452 . . . . 71.01 111.095 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 196' ' ' LEU . . . . . 0.75 HD12 ' CD1' ' A' ' 113' ' ' LEU . 4.0 mm? -66.26 -43.18 87.19 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.244 -0.434 . . . . 74.51 110.903 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -60.67 -24.29 61.94 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.79 -0.719 . . . . 52.23 112.472 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 198' ' ' HIS . . . . . 0.652 ' CD2' HG21 ' A' ' 69' ' ' VAL . 5.7 m-70 -68.08 -42.69 80.01 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.807 0.337 . . . . 75.21 110.928 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . 0.451 ' O ' ' HD3' ' A' ' 162' ' ' PRO . 41.4 t -62.15 -23.3 66.5 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.182 -0.463 . . . . 71.13 110.91 -179.854 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 1.6 mt -85.23 2.58 43.25 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.075 -0.511 . . . . 64.13 110.965 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 84.91 -9.37 66.14 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.817 -0.706 . . . . 50.41 112.434 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 202' ' ' MET . . . . . 0.417 ' CE ' ' HB ' ' A' ' 234' ' ' ILE . 0.0 OUTLIER -57.55 130.47 46.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.782 0.325 . . . . 63.21 110.915 179.962 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -101.03 175.12 25.92 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.777 -0.725 . . . . 64.44 112.451 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 17.3 m-70 -68.09 163.47 22.4 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.766 0.317 . . . . 74.32 110.909 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -127.06 156.36 41.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.228 -0.442 . . . . 53.34 110.899 -179.788 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 5.6 p -87.65 -4.28 58.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.208 -0.451 . . . . 72.22 110.817 -179.75 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 207' ' ' ASP . . . . . 0.469 ' HB2' ' HB2' ' A' ' 210' ' ' ALA . 24.4 m-20 -71.29 133.62 85.3 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-O 121.635 0.731 . . . . 65.11 110.811 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 -6.0 17.55 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.682 2.255 . . . . 74.53 112.297 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 -127.64 26.49 5.91 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.252 -0.431 . . . . 63.52 110.841 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 210' ' ' ALA . . . . . 0.469 ' HB2' ' HB2' ' A' ' 207' ' ' ASP . . . -87.4 145.65 26.21 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.234 -0.439 . . . . 62.23 111.071 179.821 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 211' ' ' VAL . . . . . 0.49 HG21 HG21 ' A' ' 193' ' ' THR . 0.4 OUTLIER -67.49 -27.35 38.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.207 -0.451 . . . . 62.04 111.128 179.959 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 35.6 mmm -93.83 6.13 49.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.454 . . . . 75.22 110.866 179.881 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 213' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -55.91 111.87 3.66 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.666 0.746 . . . . 73.43 110.955 -179.877 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.79 -17.79 37.24 Favored 'Trans proline' 0 C--N 1.341 0.135 0 C-N-CA 122.688 2.259 . . . . 63.01 112.32 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.13 60.48 5.93 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.232 -0.44 . . . . 74.24 111.1 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -46.6 122.67 4.34 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.191 -0.459 . . . . 74.14 110.914 -179.923 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -94.15 175.47 34.97 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.782 -0.723 . . . . 74.22 112.468 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -68.4 -74.47 0.12 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.841 0.353 . . . . 64.22 110.903 -179.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . -62.07 105.45 0.95 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.784 -0.722 . . . . 72.24 112.439 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 220' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -91.36 153.6 44.4 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.678 0.751 . . . . 41.43 110.857 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.7 139.17 39.76 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.622 2.214 . . . . 73.42 112.346 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -81.5 -22.74 37.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.25 -0.432 . . . . 74.21 110.91 179.992 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 25.1 t30 -114.32 -40.14 3.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.215 -0.448 . . . . 60.33 110.874 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 224' ' ' PHE . . . . . 0.594 ' HE1' HG21 ' A' ' 193' ' ' THR . 0.0 OUTLIER 66.96 134.62 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.166 -0.47 . . . . 65.01 110.864 179.996 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.86 158.59 43.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.087 -0.506 . . . . 64.24 110.963 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . 0.7 ' HB3' HD11 ' A' ' 231' ' ' ILE . 50.4 mt -69.74 148.92 48.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.231 -0.44 . . . . 53.44 110.908 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 227' ' ' SER . . . . . 0.492 ' O ' HD12 ' A' ' 231' ' ' ILE . 0.0 OUTLIER -87.17 148.49 25.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.173 -0.467 . . . . 74.21 110.886 -179.96 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.7 -64.07 0.96 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.158 -0.474 . . . . 74.54 110.919 -179.953 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -55.66 -27.68 51.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.171 -0.468 . . . . 72.22 110.852 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -70.05 -49.36 51.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.157 -0.474 . . . . 74.23 110.857 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 231' ' ' ILE . . . . . 0.7 HD11 ' HB3' ' A' ' 226' ' ' LEU . 8.3 mt -69.39 -44.27 80.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.22 -0.446 . . . . 73.41 111.135 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 1.2 ptmt -56.41 -32.58 64.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.139 -0.482 . . . . 65.42 110.901 179.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -64.95 -50.54 57.5 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.791 -0.719 . . . . 63.43 112.464 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 234' ' ' ILE . . . . . 0.497 HD11 ' CE1' ' A' ' 238' ' ' TYR . 8.0 tt -73.82 -31.11 30.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.817 0.342 . . . . 71.54 111.16 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -61.67 -23.7 66.25 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.158 -0.474 . . . . 70.33 110.889 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 236' ' ' LYS . . . . . 0.433 ' HE2' ' HB2' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.39 -24.61 59.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.252 -0.431 . . . . 51.21 110.884 179.947 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 237' ' ' LEU . . . . . 0.748 HD22 ' HD2' ' A' ' 83' ' ' LYS . 9.2 tt -93.02 -30.27 15.4 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.252 -0.431 . . . . 75.41 110.918 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 238' ' ' TYR . . . . . 0.497 ' CE1' HD11 ' A' ' 234' ' ' ILE . 46.9 m-85 -92.27 -35.4 13.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.167 -0.47 . . . . 51.24 110.921 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -115.62 -121.36 3.4 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.679 -0.772 . . . . 32.22 112.384 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 4.8 tttm -97.68 131.56 44.12 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.817 0.342 . . . . 75.42 110.919 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 7.6 ptt180 -50.59 162.23 0.26 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.189 -0.46 . . . . 73.34 110.818 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -172.92 -52.43 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 62.42 110.863 -179.831 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -97.0 -170.96 2.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.126 -0.488 . . . . 72.13 110.875 -179.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -140.48 -73.21 0.35 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 62.23 110.816 -179.828 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 63.09 175.93 0.15 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.177 -0.465 . . . . 70.43 110.931 -179.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 36.6 pttt -131.28 34.0 4.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.217 -0.447 . . . . 72.11 110.951 179.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.218 -0.446 . . . . 74.13 110.915 179.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 302' ' ' ' CA' . . . . . 0.638 'CA ' ' O ' ' A' ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' -2' ' ' LEU . . . . . . . . . . . . . 4.5 mm? . . . . . 0 C--O 1.232 0.132 0 CA-C-O 121.636 0.731 . . . . 73.02 110.91 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' -1' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.85 -173.27 0.7 Allowed 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.673 2.249 . . . . 71.15 112.319 179.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 2.4 mp -115.84 160.61 34.46 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.606 0.717 . . . . 62.13 110.89 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.67 -171.74 0.5 Allowed 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.643 2.229 . . . . 64.14 112.371 179.863 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 71.5 -69.49 0.18 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.228 -0.442 . . . . 60.51 110.918 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -56.01 -32.43 63.98 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.231 -0.44 . . . . 74.01 110.839 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.95 -34.03 67.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.207 -0.452 . . . . 71.4 111.103 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -55.91 -31.62 58.55 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.675 -0.774 . . . . 60.51 112.499 -179.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -107.84 17.86 35.13 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.793 -0.718 . . . . 54.22 112.497 -179.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 3.1 tpt -66.03 164.2 15.81 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.779 0.323 . . . . 72.23 110.883 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -52.05 147.38 7.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.26 -0.427 . . . . 73.24 110.868 -179.802 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.26 -31.95 70.7 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.149 -0.478 . . . . 50.12 110.899 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.0 -41.96 99.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.154 -0.475 . . . . 72.33 110.938 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 36.0 mm-40 -61.92 -44.61 96.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.154 -0.476 . . . . 72.14 110.918 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 6.6 t-105 -73.07 -31.32 64.32 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.156 -0.474 . . . . 71.22 110.889 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -73.32 -36.39 66.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.294 -0.412 . . . . 72.51 110.919 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -63.12 -38.09 89.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.158 -0.474 . . . . 61.24 110.851 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.66 ' HB1' ' CE ' ' A' ' 62' ' ' MET . . . -64.23 -43.66 94.27 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.207 -0.451 . . . . 54.34 111.062 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.54 ' NE2' HD12 ' A' ' 35' ' ' LEU . 0.6 OUTLIER -62.2 -43.09 99.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.215 -0.448 . . . . 73.12 110.855 -179.89 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -73.66 -31.52 63.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.208 -0.451 . . . . 72.4 110.888 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -70.74 -36.41 73.13 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.23 -0.441 . . . . 75.11 110.89 -179.819 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.686 HD13 ' O ' ' A' ' 19' ' ' LEU . 3.1 tm? -71.91 -21.04 61.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.149 -0.478 . . . . 72.51 110.973 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 5.1 ptmt -74.85 -34.62 62.31 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.156 -0.475 . . . . 74.41 110.918 179.822 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.04 -27.17 48.71 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.212 -0.449 . . . . 74.05 110.875 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -75.42 2.12 12.24 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.207 -0.451 . . . . 74.31 110.916 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.423 ' O ' ' HB2' ' A' ' 70' ' ' PRO . 7.8 m-85 -118.81 -75.59 0.58 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.166 -0.47 . . . . 72.55 110.976 -179.842 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 12.0 mt -161.78 24.63 0.12 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.113 -0.494 . . . . 75.43 110.888 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 4.2 t80 49.21 89.5 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.185 -0.461 . . . . 71.41 110.852 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -125.32 111.95 15.78 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.151 -0.477 . . . . 74.25 110.87 179.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.27 -9.32 57.86 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.257 -0.429 . . . . 62.15 110.808 -179.747 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -82.39 -15.32 53.11 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.186 -0.461 . . . . 74.51 110.872 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.4 m -88.28 9.4 23.27 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.171 -0.468 . . . . 70.44 111.138 -179.883 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -79.91 100.04 7.87 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.183 -0.462 . . . . 73.33 110.883 179.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -167.5 160.85 13.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.231 -0.44 . . . . 64.43 110.896 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.89 -38.11 61.97 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.148 -0.478 . . . . 70.21 111.136 179.844 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.8 m120 -76.28 -49.05 18.03 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.299 -0.409 . . . . 35.31 110.825 -179.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 89.0 p -60.9 -22.55 64.44 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.162 -0.472 . . . . 74.02 110.864 -179.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.54 HD12 ' NE2' ' A' ' 16' ' ' GLN . 0.6 OUTLIER -60.47 -44.49 95.84 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.125 -0.489 . . . . 72.52 110.895 -179.99 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.524 ' N ' HD23 ' A' ' 35' ' ' LEU . 0.7 OUTLIER -61.95 -51.05 69.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.244 -0.435 . . . . 73.13 110.944 179.897 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.7 -36.79 85.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.175 -0.466 . . . . 63.32 111.096 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.47 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 1.1 tttp -69.5 -49.16 57.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.191 -0.459 . . . . 72.32 110.869 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.783 HD11 HD22 ' A' ' 54' ' ' LEU . 2.1 mt -61.84 -35.62 78.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.251 -0.431 . . . . 72.11 110.909 179.968 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.74 -45.92 88.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.187 -0.461 . . . . 62.43 110.891 179.799 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.47 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 3.5 pt-20 -62.81 -32.43 73.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.26 -0.427 . . . . 75.11 110.841 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.433 ' HE3' ' CZ ' ' A' ' 46' ' ' PHE . 1.5 ttt -68.05 -34.25 76.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.18 -0.464 . . . . 63.43 110.868 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.479 ' CD ' HD11 ' A' ' 48' ' ' LEU . 2.6 mm100 -57.26 -39.22 75.19 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.265 -0.425 . . . . 74.45 110.983 -179.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.4 mmtt -68.78 -28.76 67.07 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.14 -0.482 . . . . 71.43 110.912 179.943 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -70.59 -43.84 68.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 73.32 110.881 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.443 ' CB ' HD23 ' A' ' 48' ' ' LEU . 10.3 m-85 -82.05 -34.92 29.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.157 -0.474 . . . . 70.43 110.873 -179.905 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 102.65 -8.36 54.54 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.785 -0.722 . . . . 64.34 112.575 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.479 HD11 ' CD ' ' A' ' 43' ' ' GLN . 0.9 OUTLIER -59.87 136.43 90.29 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.665 0.745 . . . . 64.11 110.874 -179.916 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.69 -51.8 0.37 Allowed 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.715 2.277 . . . . 74.5 112.369 179.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.475 HD12 HG23 ' A' ' 58' ' ' VAL . 0.9 OUTLIER -51.11 108.25 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.219 -0.446 . . . . 71.22 111.102 179.924 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 7.4 p -96.24 156.62 16.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.119 -0.492 . . . . 73.25 111.16 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 58.76 20.22 46.57 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.783 -0.722 . . . . 64.24 112.441 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.452 ' O ' HG11 ' A' ' 58' ' ' VAL . 28.4 mmt -104.99 142.76 34.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.856 0.36 . . . . 75.23 110.805 -179.919 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.783 HD22 HD11 ' A' ' 39' ' ' LEU . 32.4 tp -161.9 77.91 0.52 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.194 -0.457 . . . . 73.4 110.925 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -179.04 -29.8 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.198 -0.456 . . . . 44.35 110.869 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 26.7 t -91.45 -98.55 0.12 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.206 -0.452 . . . . 75.25 110.842 -179.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 11.1 tpt180 -84.8 -31.08 24.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.123 -0.49 . . . . 61.22 110.823 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.475 HG23 HD12 ' A' ' 50' ' ' ILE . 88.9 t -63.94 -43.27 97.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.158 -0.473 . . . . 70.12 111.159 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.445 HD13 ' HA ' ' A' ' 59' ' ' ILE . 0.4 OUTLIER -69.05 -30.83 47.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.12 -0.491 . . . . 74.43 111.188 179.921 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.52 -43.73 93.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.18 -0.464 . . . . 73.45 110.904 179.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.731 HG21 HG22 ' A' ' 215' ' ' THR . 0.0 OUTLIER -76.18 -29.82 19.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.092 -0.504 . . . . 74.52 111.123 179.973 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.66 ' CE ' ' HB1' ' A' ' 15' ' ' ALA . 10.1 mmm -68.91 -26.64 65.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.454 . . . . 74.01 110.84 179.845 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -100.07 -24.99 14.45 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.239 -0.437 . . . . 42.22 110.909 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 6.6 mtmp? -85.27 152.6 58.42 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.533 0.682 . . . . 65.34 110.929 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 152.45 69.35 Favored 'Trans proline' 0 N--CA 1.466 -0.138 0 C-N-CA 122.76 2.307 . . . . 72.11 112.303 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 2.1 ttm180 -147.99 -83.69 0.11 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.201 -0.454 . . . . 71.51 110.853 -179.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -145.72 156.57 43.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.184 -0.462 . . . . 55.3 110.882 -179.933 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.708 ' HA2' HG23 ' A' ' 155' ' ' THR . . . -94.98 9.81 70.29 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.704 -0.76 . . . . 64.23 112.51 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.515 HG12 ' HD2' ' A' ' 70' ' ' PRO . 0.2 OUTLIER -100.33 135.38 20.28 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.574 0.702 . . . . 74.23 111.157 -179.973 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.515 ' HD2' HG12 ' A' ' 69' ' ' VAL . 53.1 Cg_endo -69.77 159.81 52.0 Favored 'Trans proline' 0 N--CA 1.465 -0.196 0 C-N-CA 122.709 2.273 . . . . 63.44 112.369 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -94.37 6.66 48.05 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.272 -0.422 . . . . 74.45 110.862 179.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -156.68 145.77 11.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.159 -0.473 . . . . 53.43 111.137 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -130.86 170.4 14.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.455 . . . . 73.13 111.149 179.822 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -173.53 172.94 3.55 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.288 -0.415 . . . . 73.31 110.845 -179.901 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER 65.15 150.96 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.108 -0.496 . . . . 70.41 110.92 -179.908 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 30.2 m 63.01 109.96 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.151 -0.477 . . . . 74.2 110.912 -179.858 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -62.19 92.93 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.145 -0.48 . . . . 70.34 110.912 -179.943 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -50.38 157.8 1.15 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.717 0.77 . . . . 71.24 110.888 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.69 -177.82 2.03 Favored 'Trans proline' 0 C--N 1.343 0.239 0 C-N-CA 122.655 2.237 . . . . 73.34 112.363 180.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -86.92 146.42 26.17 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.218 -0.446 . . . . 74.43 110.892 179.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . 0.408 ' HA ' ' HD2' ' A' ' 82' ' ' PRO . 6.5 m 63.63 94.78 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.671 0.748 . . . . 70.4 110.847 -179.798 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.408 ' HD2' ' HA ' ' A' ' 81' ' ' SER . 53.4 Cg_endo -69.79 -7.48 21.18 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.707 2.271 . . . . 71.11 112.363 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.683 ' HD3' HD22 ' A' ' 237' ' ' LEU . 9.7 mtpt -117.17 148.79 41.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.229 -0.441 . . . . 64.45 110.91 179.846 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . 0.545 ' CZ3' HG11 ' A' ' 89' ' ' VAL . 39.2 m0 -47.22 109.49 0.21 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.217 -0.447 . . . . 73.31 110.884 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.0 -5.28 11.97 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.261 -0.427 . . . . 65.3 111.151 -180.0 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -61.83 164.42 6.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 70.34 110.817 -179.844 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 11.5 mmtt -70.91 -30.66 67.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.056 -0.52 . . . . 71.12 110.953 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.422 ' HA ' ' O ' ' A' ' 123' ' ' HIS . 0.3 OUTLIER -154.02 144.92 14.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.258 -0.428 . . . . 74.14 111.092 179.879 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.545 HG11 ' CZ3' ' A' ' 84' ' ' TRP . 5.5 t -130.64 137.51 55.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.206 -0.452 . . . . 72.25 111.165 179.838 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.794 HG22 ' HB3' ' A' ' 125' ' ' ARG . 3.5 p -117.71 167.97 10.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 71.01 111.151 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.446 ' O ' HG21 ' A' ' 127' ' ' VAL . 3.7 p90 -150.05 146.58 27.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.251 -0.431 . . . . 70.51 110.93 -179.956 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.473 ' HB3' ' HB3' ' A' ' 132' ' ' ALA . 5.6 ttt-85 -149.43 139.75 22.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.113 -0.494 . . . . 71.25 110.811 -179.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.505 HD11 ' HA ' ' A' ' 106' ' ' ASP . 10.8 mm -74.75 134.47 29.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.144 -0.48 . . . . 72.4 111.176 179.866 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.71 HG22 ' SD ' ' A' ' 135' ' ' MET . 10.7 t -90.03 -40.68 13.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.465 . . . . 60.2 111.137 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 2.5 t -139.63 167.06 22.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.21 -0.45 . . . . 64.24 110.828 -179.813 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 15.6 p90 -114.93 149.96 36.44 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.115 -0.493 . . . . 72.25 110.945 -179.904 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.55 ' OG1' HG21 ' A' ' 105' ' ' VAL . 0.2 OUTLIER -83.22 140.98 32.22 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.114 -0.494 . . . . 64.11 111.113 -179.973 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.33 -8.47 55.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 72.14 110.806 -179.957 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -96.82 -25.61 15.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.252 -0.431 . . . . 74.13 110.818 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.658 HD21 ' HA ' ' A' ' 179' ' ' THR . 0.8 OUTLIER -135.84 153.44 77.18 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.632 0.73 . . . . 72.52 110.9 -179.944 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . 0.618 ' HB2' HG22 ' A' ' 103' ' ' ILE . 53.4 Cg_endo -69.79 151.12 68.81 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.666 2.244 . . . . 73.11 112.361 179.919 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 5.2 t-160 -53.96 -25.72 22.16 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.234 -0.439 . . . . 74.11 110.868 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.618 HG22 ' HB2' ' A' ' 101' ' ' PRO . 15.1 tt -75.57 -38.33 38.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.212 -0.449 . . . . 74.02 111.15 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . 0.665 ' O ' HD22 ' A' ' 108' ' ' LEU . 3.1 m -69.2 -39.49 78.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.147 -0.479 . . . . 52.11 111.119 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.751 ' O ' HG13 ' A' ' 109' ' ' VAL . 92.9 t -72.93 -45.41 55.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.214 -0.448 . . . . 71.51 111.143 179.901 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.636 ' O ' HG22 ' A' ' 109' ' ' VAL . 49.8 t0 -61.5 -44.55 96.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.13 -0.486 . . . . 63.44 110.92 179.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 1.7 ptm180 -69.93 -33.55 72.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.171 -0.468 . . . . 75.02 110.854 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.665 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -60.64 -49.07 79.02 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.15 -0.477 . . . . 71.04 110.954 -179.97 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.751 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.4 m -55.61 -42.2 67.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.199 -0.455 . . . . 72.31 111.132 179.791 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.472 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 34.9 t -70.19 -34.16 72.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.157 -0.474 . . . . 72.14 110.889 -179.854 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.454 ' CG ' HD21 ' A' ' 189' ' ' LEU . 0.4 OUTLIER -62.56 -33.36 74.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.091 -0.504 . . . . 74.35 110.842 -179.998 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -95.09 -40.9 9.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.26 -0.427 . . . . 74.32 111.085 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.739 ' CD1' HD12 ' A' ' 196' ' ' LEU . 0.4 OUTLIER -65.65 -33.12 75.16 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.254 -0.43 . . . . 72.0 110.914 -179.982 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 29.6 t-20 -64.83 -40.95 96.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.177 -0.465 . . . . 72.34 110.861 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . 0.72 ' O ' HD11 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -57.8 -34.62 69.83 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.158 -0.473 . . . . 54.12 110.895 179.953 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 9.1 m95 -66.73 -52.36 45.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.186 -0.461 . . . . 75.23 110.887 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . 0.457 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -59.96 -37.39 92.59 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.745 -0.74 . . . . 73.32 112.485 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.4 mmpt? -61.82 -16.86 53.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.777 0.322 . . . . 72.42 110.91 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.798 ' HG2' HD13 ' A' ' 226' ' ' LEU . 0.4 OUTLIER -101.01 13.27 35.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.249 -0.432 . . . . 75.24 110.885 179.96 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.457 ' CG1' ' HA2' ' A' ' 117' ' ' GLY . 2.2 pt -147.16 146.39 25.4 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.641 0.734 . . . . 71.34 111.156 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.72 6.22 1.38 Allowed 'Trans proline' 0 C--O 1.232 0.225 0 C-N-CA 122.809 2.339 . . . . 72.21 112.318 179.895 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.442 ' HA ' HD23 ' A' ' 122' ' ' LEU . 4.9 mt -62.52 -156.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.223 -0.444 . . . . 73.22 110.963 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.422 ' O ' ' HA ' ' A' ' 88' ' ' VAL . 3.8 t60 -158.67 127.37 5.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.223 -0.444 . . . . 74.12 110.862 179.851 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 11.5 m-30 -110.49 142.85 41.7 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.191 -0.459 . . . . 75.54 110.907 -179.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.794 ' HB3' HG22 ' A' ' 90' ' ' THR . 0.0 OUTLIER -117.96 140.17 50.12 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.162 -0.472 . . . . 75.14 110.944 -179.968 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.79 142.18 32.83 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.228 -0.442 . . . . 72.22 110.868 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . 0.818 HG11 ' HB2' ' A' ' 132' ' ' ALA . 30.3 m -103.23 140.33 21.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.189 -0.459 . . . . 50.13 111.131 179.852 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.402 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -156.41 -27.54 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.205 -0.452 . . . . 74.43 111.129 179.941 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' TRP . . . . . 0.402 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -135.35 109.2 8.1 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.174 -0.467 . . . . 71.25 110.939 179.994 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.97 -158.52 14.83 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.757 -0.735 . . . . 62.11 112.498 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.9 156.29 17.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.8 0.333 . . . . 63.25 111.13 -179.841 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . 0.818 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -111.59 165.46 11.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.172 -0.467 . . . . 51.34 111.096 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -66.38 -62.58 1.39 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.23 -0.441 . . . . 75.41 110.907 179.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . 0.43 HG22 HD13 ' A' ' 136' ' ' ILE . 4.5 mp -82.72 142.55 13.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.112 -0.494 . . . . 70.51 111.148 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . 0.71 ' SD ' HG22 ' A' ' 94' ' ' VAL . 27.9 mmt -113.14 119.25 37.18 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.172 -0.467 . . . . 72.43 110.843 179.861 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.438 HG21 HG11 ' A' ' 109' ' ' VAL . 1.0 OUTLIER -105.61 89.91 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.191 -0.459 . . . . 70.04 111.147 179.928 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -129.93 167.92 21.5 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.771 -0.728 . . . . 63.34 112.501 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' PHE . . . . . 0.562 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 32.7 m-85 -104.89 149.96 25.26 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.828 0.347 . . . . 74.01 110.848 -179.845 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.562 ' HB2' ' O ' ' A' ' 138' ' ' PHE . . . 169.59 165.93 0.05 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.158 -0.473 . . . . 71.21 111.08 179.851 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 4.6 ptt85 -109.45 174.27 5.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.227 -0.442 . . . . 62.21 110.908 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . 0.498 ' H ' ' HA ' ' A' ' 149' ' ' PHE . . . -55.03 -16.68 8.48 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.695 -0.764 . . . . 74.24 112.528 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . 0.502 ' HB2' ' CD2' ' A' ' 149' ' ' PHE . . . -91.45 13.13 18.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.817 0.342 . . . . 75.03 111.115 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . 0.467 ' HB3' ' HB1' ' A' ' 139' ' ' ALA . 4.1 p80 -80.52 -0.99 39.98 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.199 -0.455 . . . . 71.11 110.911 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 107.3 45.15 1.18 Allowed Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.719 -0.753 . . . . 45.51 112.408 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 39.9 p-10 -146.05 168.82 20.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.843 0.354 . . . . 72.14 110.877 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.0 164.96 9.62 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.142 -0.481 . . . . 51.25 110.881 -179.744 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 64.73 132.37 0.03 OUTLIER Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.65 0.738 . . . . 73.4 110.916 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.67 151.02 69.47 Favored 'Trans proline' 0 C--O 1.231 0.125 0 C-N-CA 122.715 2.276 . . . . 74.53 112.342 179.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 149' ' ' PHE . . . . . 0.502 ' CD2' ' HB2' ' A' ' 142' ' ' ALA . 7.0 p90 -53.94 -41.94 68.28 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.227 -0.442 . . . . 63.52 110.906 179.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 76.69 -22.69 0.27 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.118 -0.492 . . . . 63.11 110.861 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . 0.434 ' H ' ' C ' ' A' ' 149' ' ' PHE . . . 74.8 -149.55 39.94 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.812 -0.709 . . . . 71.41 112.472 -179.914 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.71 142.35 47.89 Favored 'Trans proline' 0 C--N 1.341 0.137 0 C-N-CA 122.666 2.244 . . . . 75.11 112.349 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . 0.448 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 104.34 -139.45 14.58 Favored Glycine 0 N--CA 1.453 -0.197 0 C-N-CA 120.669 -0.777 . . . . 70.32 112.456 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 154' ' ' ASN . . . . . 0.448 ' C ' ' O ' ' A' ' 153' ' ' GLY . 4.0 p30 -34.77 140.93 0.07 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.963 0.411 . . . . 73.25 110.895 -179.871 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 155' ' ' THR . . . . . 0.708 HG23 ' HA2' ' A' ' 68' ' ' GLY . 1.6 m 78.21 107.19 0.07 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.136 -0.484 . . . . 44.41 111.141 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . 0.995 HD21 HG21 ' A' ' 186' ' ' ILE . 0.8 OUTLIER -93.8 -54.69 3.52 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.211 -0.449 . . . . 75.02 110.921 179.921 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . 0.592 ' HB1' ' O ' ' A' ' 171' ' ' HIS . . . -158.56 148.0 19.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.177 -0.465 . . . . 71.42 111.069 179.843 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 26.5 p-80 -109.67 122.47 47.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.21 -0.45 . . . . 72.02 110.824 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.446 ' H ' HG22 ' A' ' 69' ' ' VAL . . . -109.59 160.63 16.09 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.221 -0.445 . . . . 74.42 111.13 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 11.8 m-85 -118.4 156.29 29.23 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.208 -0.451 . . . . 75.31 110.865 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . 0.739 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -82.85 165.29 42.42 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.543 0.687 . . . . 61.04 111.127 179.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 162' ' ' PRO . . . . . 0.739 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 53.6 Cg_endo -69.89 67.69 1.8 Allowed 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.668 2.246 . . . . 74.44 112.345 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -127.82 107.11 0.84 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.733 -0.746 . . . . 61.41 112.527 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 164' ' ' THR . . . . . 0.485 HG22 ' H ' ' A' ' 165' ' ' GLY . 0.2 OUTLIER 72.83 174.39 0.29 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.888 0.375 . . . . 73.1 111.119 -179.886 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . 0.485 ' H ' HG22 ' A' ' 164' ' ' THR . . . -50.06 -57.59 9.82 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.776 -0.725 . . . . 74.03 112.433 -179.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -60.48 -18.03 48.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.895 0.378 . . . . 65.12 110.964 -179.937 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -68.87 146.8 45.5 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.766 -0.731 . . . . 43.43 112.55 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 81.33 11.78 82.94 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.751 -0.738 . . . . 74.31 112.487 -179.871 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 57.6 m-20 -79.8 148.83 31.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.848 0.356 . . . . 63.41 110.802 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.26 130.41 55.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.148 -0.478 . . . . 74.21 111.084 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 171' ' ' HIS . . . . . 0.592 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 20.6 m170 -126.86 132.4 50.96 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.218 -0.446 . . . . 72.53 110.911 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 32.2 m-85 -113.7 139.56 48.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.268 -0.424 . . . . 71.44 110.841 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 55.0 t0 -71.63 100.69 2.35 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.129 -0.487 . . . . 74.11 110.809 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.71 -16.73 11.86 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.223 -0.444 . . . . 72.25 110.937 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -77.99 -16.26 58.27 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.104 -0.498 . . . . 73.32 110.911 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -85.05 -174.39 5.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.157 -0.474 . . . . 63.2 110.864 -179.873 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 6.4 mtt85 -112.33 115.14 28.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.156 -0.474 . . . . 63.14 110.85 -179.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 58.9 m95 -115.97 138.5 51.14 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.153 -0.476 . . . . 72.31 110.882 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 179' ' ' THR . . . . . 0.658 ' HA ' HD21 ' A' ' 100' ' ' LEU . 7.3 t -176.87 163.57 2.25 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.241 -0.436 . . . . 74.13 111.175 -179.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -125.06 -68.71 0.83 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.277 -0.419 . . . . 45.33 110.84 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -65.14 -11.68 52.59 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.757 -0.735 . . . . 62.41 112.479 -179.9 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 182' ' ' SER . . . . . 0.524 ' HB3' HG21 ' A' ' 179' ' ' THR . 0.3 OUTLIER -95.38 -24.24 16.8 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.845 0.355 . . . . 64.5 110.84 -179.698 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 183' ' ' SER . . . . . 0.429 ' C ' ' O ' ' A' ' 182' ' ' SER . 89.9 p 34.97 58.87 0.73 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.086 -0.506 . . . . 64.12 110.869 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 2.2 tp -116.73 -33.67 4.74 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.105 -0.498 . . . . 74.2 110.887 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . -119.58 -138.41 5.71 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.754 -0.736 . . . . 73.01 112.489 179.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 186' ' ' ILE . . . . . 0.995 HG21 HD21 ' A' ' 156' ' ' LEU . 6.1 mm -79.51 98.75 3.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.897 0.379 . . . . 73.22 111.142 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -46.65 127.25 9.37 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.132 -0.486 . . . . 71.31 110.886 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 188' ' ' PHE . . . . . 0.718 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 1.2 t80 -60.66 -37.39 81.42 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.217 -0.447 . . . . 75.45 110.93 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . 0.454 HD21 ' CG ' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -66.7 -47.89 70.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.129 -0.487 . . . . 52.02 110.933 179.942 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 48.8 t80 -69.7 -38.57 77.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.464 . . . . 74.22 110.948 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 191' ' ' ALA . . . . . 0.643 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -72.88 -35.91 67.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.085 -0.507 . . . . 50.03 111.068 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 192' ' ' ALA . . . . . 0.692 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -57.26 -45.23 84.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.194 -0.457 . . . . 52.11 111.057 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 193' ' ' THR . . . . . 0.593 HG21 ' HE1' ' A' ' 224' ' ' PHE . 0.2 OUTLIER -58.39 -41.94 86.0 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.159 -0.473 . . . . 72.43 111.167 -179.883 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 4.9 t60 -72.71 -45.56 58.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.199 -0.455 . . . . 71.44 110.853 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -68.02 -47.96 67.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.202 -0.454 . . . . 71.01 111.079 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 196' ' ' LEU . . . . . 0.739 HD12 ' CD1' ' A' ' 113' ' ' LEU . 4.4 mm? -63.71 -37.32 86.92 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.199 -0.455 . . . . 74.51 110.954 -179.929 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -61.97 -26.46 67.33 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.783 -0.723 . . . . 52.23 112.541 179.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 198' ' ' HIS . . . . . 0.493 ' CD2' HG21 ' A' ' 69' ' ' VAL . 6.1 m-70 -68.83 -42.87 76.61 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.753 0.311 . . . . 75.21 110.84 -179.969 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.18 -27.59 65.82 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.452 . . . . 71.13 110.888 -179.765 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -84.78 0.17 51.66 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.041 -0.527 . . . . 64.13 110.938 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 88.36 -9.37 75.65 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.697 -0.764 . . . . 50.41 112.444 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 202' ' ' MET . . . . . 0.464 ' CE ' ' HB ' ' A' ' 234' ' ' ILE . 0.4 OUTLIER -60.33 127.14 30.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.838 0.352 . . . . 63.21 110.886 -179.995 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -101.03 178.86 28.44 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.781 -0.724 . . . . 64.44 112.486 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 18.4 m-70 -68.94 159.65 32.29 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.821 0.343 . . . . 74.32 110.86 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 205' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -122.25 157.36 31.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.204 -0.453 . . . . 53.34 110.807 -179.764 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -87.88 -4.43 58.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.084 -0.507 . . . . 72.22 110.863 -179.827 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.44 137.49 83.68 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.681 0.753 . . . . 65.11 110.871 179.943 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 -6.68 19.17 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.694 2.263 . . . . 74.53 112.348 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 -127.61 33.48 4.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.213 -0.449 . . . . 63.52 110.896 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 210' ' ' ALA . . . . . 0.51 ' HA ' ' CB ' ' A' ' 227' ' ' SER . . . -87.14 145.99 26.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.156 -0.475 . . . . 62.23 111.104 179.851 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -73.47 -26.86 22.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.213 -0.449 . . . . 62.04 111.2 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 212' ' ' MET . . . . . 0.451 ' HE1' ' HB2' ' A' ' 202' ' ' MET . 16.3 tpp -94.76 6.94 47.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.14 -0.482 . . . . 75.22 110.846 179.953 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 213' ' ' TYR . . . . . 0.429 ' HB2' ' O ' ' A' ' 210' ' ' ALA . 0.1 OUTLIER -56.2 127.32 70.21 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.703 0.763 . . . . 73.43 110.929 -179.857 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.77 -29.57 23.63 Favored 'Trans proline' 0 C--O 1.231 0.159 0 C-N-CA 122.687 2.258 . . . . 63.01 112.357 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 215' ' ' THR . . . . . 0.731 HG22 HG21 ' A' ' 61' ' ' ILE . 60.4 p -84.42 62.23 7.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.214 -0.448 . . . . 74.24 111.205 179.964 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 -42.43 145.88 0.38 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.247 -0.433 . . . . 74.14 110.906 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -63.96 169.96 20.51 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.732 -0.747 . . . . 74.22 112.563 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 26.5 t30 -54.59 -74.03 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.895 0.378 . . . . 64.22 110.88 -179.884 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . -83.7 -142.89 5.22 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.791 -0.719 . . . . 72.24 112.512 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 220' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -120.12 153.58 55.47 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.645 0.736 . . . . 41.43 110.873 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.73 120.51 7.29 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.691 2.26 . . . . 73.42 112.378 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -54.44 -44.93 72.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 74.21 110.855 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -123.26 -36.04 2.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.238 -0.437 . . . . 60.33 110.86 -179.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 224' ' ' PHE . . . . . 0.593 ' HE1' HG21 ' A' ' 193' ' ' THR . 0.0 OUTLIER 65.92 129.58 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.166 -0.47 . . . . 65.01 110.901 -179.952 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -143.6 159.24 42.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.153 -0.476 . . . . 64.24 110.964 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . 0.798 HD13 ' HG2' ' A' ' 119' ' ' GLU . 29.9 mt -65.5 148.79 51.14 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.286 -0.415 . . . . 53.44 110.924 179.93 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 227' ' ' SER . . . . . 0.51 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 1.8 t -87.65 151.71 22.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.216 -0.447 . . . . 74.21 110.83 -179.922 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.54 -63.0 1.15 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.115 -0.493 . . . . 74.54 110.89 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -55.7 -27.47 50.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.163 -0.471 . . . . 72.22 110.842 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -70.58 -49.41 48.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.279 -0.418 . . . . 74.23 110.885 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 231' ' ' ILE . . . . . 0.707 HD11 ' HB3' ' A' ' 226' ' ' LEU . 9.5 mt -69.34 -45.03 79.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 73.41 111.101 179.972 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.21 -33.18 67.25 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.238 -0.437 . . . . 65.42 110.867 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -63.12 -49.49 71.09 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.81 -0.709 . . . . 63.43 112.467 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 234' ' ' ILE . . . . . 0.555 HD11 ' CE1' ' A' ' 238' ' ' TYR . 6.8 tt -72.59 -29.1 29.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.814 0.34 . . . . 71.54 111.16 180.0 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -60.23 -28.51 68.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.159 -0.473 . . . . 70.33 110.944 179.945 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 236' ' ' LYS . . . . . 0.442 ' HD3' ' N ' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.67 -27.3 60.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.241 -0.436 . . . . 51.21 110.92 179.915 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 237' ' ' LEU . . . . . 0.683 HD22 ' HD3' ' A' ' 83' ' ' LYS . 8.2 tt -97.48 -24.59 15.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.213 -0.449 . . . . 75.41 110.936 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 238' ' ' TYR . . . . . 0.555 ' CE1' HD11 ' A' ' 234' ' ' ILE . 3.8 m-85 -92.31 -35.38 13.78 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.452 . . . . 51.24 110.925 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -152.77 -117.31 0.69 Allowed Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.763 -0.732 . . . . 32.22 112.475 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -83.65 143.53 30.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.818 0.342 . . . . 75.42 110.886 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 5.9 ptm180 -78.8 -174.08 3.78 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.141 -0.482 . . . . 73.34 110.876 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 5.5 m -160.73 -43.77 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.131 -0.486 . . . . 62.42 110.778 -179.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 2.9 t30 -163.95 -171.95 2.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.216 -0.447 . . . . 72.13 110.851 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 10.1 p -98.91 -179.9 4.42 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.122 -0.49 . . . . 62.23 110.854 -179.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 30.2 ptt180 -167.72 -173.73 2.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.084 -0.507 . . . . 70.43 110.837 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 9.6 mmtm -143.97 140.2 29.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.191 -0.459 . . . . 72.11 110.847 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 15.5 tptm . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.185 -0.462 . . . . 74.13 110.87 179.856 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 302' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' -2' ' ' LEU . . . . . . . . . . . . . 2.7 tp . . . . . 0 C--O 1.231 0.087 0 CA-C-O 121.649 0.738 . . . . 73.02 110.908 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' -1' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.85 84.41 0.67 Allowed 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.724 2.283 . . . . 71.15 112.305 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 0' ' ' LEU . . . . . 0.494 ' N ' ' HD2' ' A' ' 1' ' ' PRO . 0.2 OUTLIER -59.45 -60.39 10.72 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-O 121.551 0.691 . . . . 62.13 110.904 179.995 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.494 ' HD2' ' N ' ' A' ' 0' ' ' LEU . 53.5 Cg_endo -69.72 -173.11 0.65 Allowed 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.685 2.257 . . . . 64.14 112.354 179.85 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -113.79 119.37 37.12 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.276 -0.42 . . . . 60.51 110.897 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -95.41 -22.57 17.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.275 -0.42 . . . . 74.01 110.887 -179.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.75 ' HB3' ' OD1' ' A' ' 55' ' ' ASN . . . -56.39 -33.95 66.25 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.115 -0.493 . . . . 71.4 111.109 179.865 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -55.8 -29.66 55.17 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.799 -0.715 . . . . 60.51 112.512 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -109.0 -8.62 27.42 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.741 -0.742 . . . . 54.22 112.497 -179.887 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 39.5 mtt -60.81 164.25 4.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.777 0.322 . . . . 72.23 110.872 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -81.29 168.61 18.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.203 -0.453 . . . . 73.24 110.858 -179.816 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -58.03 -31.86 67.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.125 -0.489 . . . . 50.12 110.927 179.936 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.9 mp -60.45 -42.67 96.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.131 -0.486 . . . . 72.33 110.945 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 69.3 mm-40 -61.71 -43.39 98.95 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.163 -0.472 . . . . 72.14 110.955 179.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 15.2 t-105 -73.15 -30.93 63.94 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.185 -0.461 . . . . 71.22 110.958 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -73.27 -35.26 66.15 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.236 -0.438 . . . . 72.51 110.825 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.98 -39.26 94.18 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.205 -0.452 . . . . 61.24 110.864 -179.876 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.22 -35.13 69.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.174 -0.466 . . . . 54.34 111.069 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.488 ' NE2' HD12 ' A' ' 35' ' ' LEU . 0.0 OUTLIER -67.31 -40.07 85.97 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.251 -0.431 . . . . 73.12 110.896 -179.899 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -77.18 -31.71 55.61 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.191 -0.459 . . . . 72.4 110.873 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -62.73 -36.16 82.09 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.185 -0.461 . . . . 75.11 110.926 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.745 HD13 ' O ' ' A' ' 19' ' ' LEU . 1.8 tm? -71.38 -21.04 62.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.124 -0.489 . . . . 72.51 110.896 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 4.4 ptmt -74.8 -29.81 61.22 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.206 -0.452 . . . . 74.41 110.928 179.829 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.6 ptp85 -86.59 -28.03 23.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.205 -0.452 . . . . 74.05 110.905 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 13.0 m-85 -68.82 -10.66 58.05 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.157 -0.474 . . . . 74.31 110.814 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.526 ' HB3' HG21 ' A' ' 72' ' ' VAL . 8.3 m-85 -120.34 -61.52 1.57 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.197 -0.456 . . . . 72.55 110.92 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.53 ' HG ' HG23 ' A' ' 72' ' ' VAL . 11.9 mt -161.49 -86.74 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.135 -0.484 . . . . 75.43 110.906 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -178.93 89.84 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.228 -0.442 . . . . 71.41 110.989 -179.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -116.36 90.41 3.33 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.158 -0.473 . . . . 74.25 110.809 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 11.6 p -85.37 -33.5 21.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.218 -0.446 . . . . 62.15 110.801 -179.77 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.4 pm0 -75.61 -13.04 60.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.213 -0.449 . . . . 74.51 110.913 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 68.0 m -76.96 -17.5 58.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.187 -0.46 . . . . 70.44 111.093 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.7 mtmp? -53.59 101.91 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.243 -0.435 . . . . 73.33 110.856 179.857 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -171.11 151.97 3.35 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.251 -0.431 . . . . 64.43 110.888 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.43 -20.0 66.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.146 -0.479 . . . . 70.21 111.168 179.835 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -85.04 -48.89 8.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.183 -0.462 . . . . 35.31 110.932 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -75.12 -21.36 58.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.131 -0.486 . . . . 74.02 110.837 -179.86 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.488 HD12 ' NE2' ' A' ' 16' ' ' GLN . 2.3 tt -63.33 -44.51 94.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.209 -0.451 . . . . 72.52 110.982 179.952 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.415 ' N ' HD23 ' A' ' 35' ' ' LEU . 0.1 OUTLIER -64.09 -51.22 65.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.184 -0.462 . . . . 73.13 110.872 179.935 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.5 -51.04 68.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.076 -0.511 . . . . 63.32 111.138 179.898 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.521 ' HD3' HD12 ' A' ' 19' ' ' LEU . 5.9 tttp -59.94 -49.35 78.03 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.222 -0.445 . . . . 72.32 110.891 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.42 ' O ' ' HG2' ' A' ' 43' ' ' GLN . 0.1 OUTLIER -58.04 -36.4 72.69 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.261 -0.427 . . . . 72.11 110.909 179.922 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.2 tttm -58.99 -45.7 90.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.151 -0.477 . . . . 62.43 110.847 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.484 ' HG2' ' O ' ' A' ' 38' ' ' LYS . 3.2 pt-20 -60.58 -32.62 71.72 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.226 -0.443 . . . . 75.11 110.905 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 7.5 ttt -68.37 -33.99 75.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.197 -0.456 . . . . 63.43 110.892 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.767 ' OE1' HD11 ' A' ' 48' ' ' LEU . 1.3 mm-40 -61.33 -39.66 91.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.242 -0.435 . . . . 74.45 110.964 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.2 mmpt? -72.39 -32.97 66.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 71.43 110.862 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 56.3 t80 -70.63 -40.68 72.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.181 -0.463 . . . . 73.32 110.839 180.0 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.863 ' CZ ' HD13 ' A' ' 61' ' ' ILE . 3.3 m-85 -82.25 -35.16 28.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.185 -0.462 . . . . 70.43 110.819 -179.829 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 104.05 -10.17 51.34 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.784 -0.722 . . . . 64.34 112.489 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.767 HD11 ' OE1' ' A' ' 43' ' ' GLN . 0.8 OUTLIER -60.11 138.13 91.24 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.518 0.675 . . . . 64.11 110.936 -179.93 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.502 ' O ' HG23 ' A' ' 51' ' ' THR . 53.9 Cg_endo -69.77 -53.55 0.26 Allowed 'Trans proline' 0 C--O 1.231 0.151 0 C-N-CA 122.713 2.276 . . . . 74.5 112.35 179.853 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.508 ' CD1' HG23 ' A' ' 58' ' ' VAL . 0.9 OUTLIER -51.9 108.25 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 71.22 111.196 179.934 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.721 HG22 ' CB ' ' A' ' 43' ' ' GLN . 39.8 p -113.96 151.5 32.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.155 -0.475 . . . . 73.25 111.149 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 76.46 -0.61 63.84 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.756 -0.735 . . . . 64.24 112.528 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.511 ' O ' HG21 ' A' ' 58' ' ' VAL . 2.9 mtt -135.22 161.08 36.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.836 0.35 . . . . 75.23 110.892 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.72 ' CD1' HD13 ' A' ' 59' ' ' ILE . 2.8 pp -156.78 128.63 7.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.271 -0.422 . . . . 73.4 110.882 -179.945 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.75 ' OD1' ' HB3' ' A' ' 4' ' ' ALA . 2.4 t30 173.01 -28.67 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.165 -0.471 . . . . 44.35 110.836 179.816 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 23.1 p -96.85 -87.09 0.32 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.216 -0.447 . . . . 75.25 110.856 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.701 ' O ' HG23 ' A' ' 61' ' ' ILE . 0.1 OUTLIER -84.49 -34.77 23.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.187 -0.46 . . . . 61.22 110.864 -179.972 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.527 ' O ' HG13 ' A' ' 61' ' ' ILE . 14.1 t -59.94 -46.92 93.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.224 -0.444 . . . . 70.12 111.143 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.72 HD13 ' CD1' ' A' ' 54' ' ' LEU . 4.0 tp -75.61 -32.14 24.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.165 -0.471 . . . . 74.43 111.099 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -59.92 -44.24 94.42 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.208 -0.451 . . . . 73.45 110.884 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.863 HD13 ' CZ ' ' A' ' 46' ' ' PHE . 1.7 pp -67.94 -29.52 45.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.225 -0.443 . . . . 74.52 111.098 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 4.7 mmt -61.68 -39.16 90.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.192 -0.458 . . . . 74.01 110.806 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -90.26 -26.29 20.13 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.275 -0.421 . . . . 42.22 110.935 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 4.1 mtmp? -85.21 133.95 41.73 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.573 0.701 . . . . 65.34 110.864 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.7 149.85 67.83 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.69 2.26 . . . . 72.11 112.368 179.84 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.31 -78.63 0.2 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.198 -0.455 . . . . 71.51 110.875 -179.934 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 16.0 p -145.29 141.51 28.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.186 -0.461 . . . . 55.3 110.852 -179.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.573 ' N ' ' O ' ' A' ' 157' ' ' ALA . . . -90.32 17.2 55.16 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.768 -0.729 . . . . 64.23 112.518 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.686 HG12 ' HD2' ' A' ' 70' ' ' PRO . 0.0 OUTLIER -110.52 141.19 23.48 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.556 0.693 . . . . 74.23 111.154 -179.955 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.686 ' HD2' HG12 ' A' ' 69' ' ' VAL . 53.7 Cg_endo -69.75 -179.86 3.2 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.615 2.21 . . . . 63.44 112.367 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -139.33 27.33 2.32 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.211 -0.449 . . . . 74.45 110.902 179.917 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.53 HG23 ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -136.56 130.07 46.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.207 -0.451 . . . . 53.43 111.128 -179.943 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -130.7 170.35 14.44 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.206 -0.452 . . . . 73.13 111.093 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -161.24 172.73 16.15 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.152 -0.476 . . . . 73.31 110.851 -179.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -51.99 137.65 26.6 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.162 -0.472 . . . . 70.41 110.961 -179.895 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 179.79 179.3 0.52 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.172 -0.467 . . . . 74.2 110.94 -179.78 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -77.25 58.58 1.64 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.145 -0.48 . . . . 70.34 110.956 179.938 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -104.99 160.73 24.98 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.704 0.764 . . . . 71.24 110.885 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.81 -174.89 1.0 Allowed 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.733 2.289 . . . . 73.34 112.284 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 8.4 m-80 -128.29 97.3 4.7 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.17 -0.468 . . . . 74.43 110.925 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -179.91 121.99 0.22 Allowed Pre-proline 0 C--N 1.33 -0.258 0 CA-C-O 121.597 0.713 . . . . 70.4 110.854 -179.81 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.79 -47.14 0.98 Allowed 'Trans proline' 0 C--O 1.232 0.213 0 C-N-CA 122.659 2.24 . . . . 71.11 112.362 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.738 ' CD ' HD22 ' A' ' 237' ' ' LEU . 0.0 OUTLIER -140.07 -178.47 5.47 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.237 -0.438 . . . . 64.45 110.898 179.865 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . 0.7 ' CE3' HG21 ' A' ' 89' ' ' VAL . 38.1 m0 -59.11 109.77 0.92 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 73.31 110.958 179.926 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 12.0 t -104.49 -14.87 15.53 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.289 -0.414 . . . . 65.3 111.092 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -56.76 152.45 12.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.261 -0.427 . . . . 70.34 110.87 -179.867 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.95 -30.58 71.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.163 -0.471 . . . . 71.12 110.875 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.58 HG23 ' CD2' ' A' ' 123' ' ' HIS . 0.8 OUTLIER -156.94 144.12 10.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.28 -0.418 . . . . 74.14 111.122 179.86 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.7 HG21 ' CE3' ' A' ' 84' ' ' TRP . 64.7 t -124.36 138.99 52.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.192 -0.458 . . . . 72.25 111.131 179.884 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.676 HG22 ' HB3' ' A' ' 125' ' ' ARG . 1.1 p -115.83 151.14 35.81 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.159 -0.473 . . . . 71.01 111.127 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 5.4 p90 -133.11 146.55 51.71 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.218 -0.447 . . . . 70.51 110.939 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -148.29 138.17 22.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.102 -0.499 . . . . 71.25 110.832 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.421 HD11 ' HA ' ' A' ' 106' ' ' ASP . 11.7 mm -77.59 135.18 26.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.167 -0.47 . . . . 72.4 111.141 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.458 ' HB ' ' HA3' ' A' ' 137' ' ' GLY . 15.3 t -91.37 -40.5 12.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.173 -0.467 . . . . 60.2 111.14 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 3.8 t -141.44 169.44 17.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.145 -0.479 . . . . 64.24 110.859 -179.755 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 12.2 p90 -117.27 150.34 38.95 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.177 -0.465 . . . . 72.25 110.94 -179.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.54 ' OG1' HG21 ' A' ' 105' ' ' VAL . 0.2 OUTLIER -82.87 141.06 32.53 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.145 -0.48 . . . . 64.11 111.17 -179.986 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 2.0 ptt180 -72.42 -8.07 53.09 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.207 -0.451 . . . . 72.14 110.852 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -96.63 -25.94 15.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.218 -0.446 . . . . 74.13 110.801 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.5 HD22 HG21 ' A' ' 104' ' ' THR . 0.7 OUTLIER -135.54 152.67 76.78 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.675 0.75 . . . . 72.52 110.902 -179.974 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . 0.599 ' HB2' HG22 ' A' ' 103' ' ' ILE . 54.1 Cg_endo -69.69 151.04 69.41 Favored 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.706 2.271 . . . . 73.11 112.336 179.915 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 6.0 t-160 -52.91 -25.71 12.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.191 -0.459 . . . . 74.11 110.884 179.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.599 HG22 ' HB2' ' A' ' 101' ' ' PRO . 13.9 tt -76.74 -39.14 31.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.223 -0.444 . . . . 74.02 111.153 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . 0.647 ' O ' HD22 ' A' ' 108' ' ' LEU . 3.4 m -69.07 -40.06 78.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 52.11 111.179 179.938 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.746 HG13 ' CZ ' ' A' ' 188' ' ' PHE . 90.7 t -72.99 -45.35 55.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.213 -0.449 . . . . 71.51 111.137 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.625 ' O ' HG22 ' A' ' 109' ' ' VAL . 48.1 t0 -61.3 -45.11 95.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.164 -0.471 . . . . 63.44 110.835 179.873 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 4.7 ptm85 -69.71 -33.31 72.32 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.196 -0.457 . . . . 75.02 110.902 -179.873 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.647 HD22 ' O ' ' A' ' 104' ' ' THR . 0.0 OUTLIER -60.38 -48.72 80.53 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.241 -0.436 . . . . 71.04 110.911 179.957 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.732 HG13 ' O ' ' A' ' 105' ' ' VAL . 1.2 m -55.44 -41.89 64.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.173 -0.467 . . . . 72.31 111.104 179.824 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.471 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 47.2 t -70.0 -34.35 73.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.204 -0.453 . . . . 72.14 110.838 -179.787 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.456 ' CG ' HD21 ' A' ' 189' ' ' LEU . 0.4 OUTLIER -62.51 -33.4 74.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.186 -0.461 . . . . 74.35 110.906 179.939 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.416 ' CB ' ' HB3' ' A' ' 192' ' ' ALA . . . -93.27 -40.61 10.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.206 -0.452 . . . . 74.32 111.061 179.846 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.743 ' CD1' HD12 ' A' ' 196' ' ' LEU . 0.7 OUTLIER -64.85 -33.35 75.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.232 -0.44 . . . . 72.0 110.928 -179.937 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -67.31 -40.99 86.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.233 -0.44 . . . . 72.34 110.882 179.88 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . 0.768 ' O ' HD11 ' A' ' 226' ' ' LEU . 0.0 OUTLIER -57.93 -34.35 69.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.184 -0.462 . . . . 54.12 110.921 179.89 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' TRP . . . . . 0.451 ' O ' HG12 ' A' ' 120' ' ' ILE . 6.5 m95 -64.84 -49.6 69.95 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.172 -0.467 . . . . 75.23 110.938 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . 0.604 ' HA2' ' CG1' ' A' ' 120' ' ' ILE . . . -73.02 -24.92 74.96 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.801 -0.714 . . . . 73.32 112.468 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.444 ' HE3' ' HA ' ' A' ' 115' ' ' MET . 0.3 OUTLIER -64.52 -13.95 54.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.736 0.303 . . . . 72.42 110.921 -179.985 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.578 ' CD ' HG21 ' A' ' 231' ' ' ILE . 1.7 mm-40 -112.61 13.91 20.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.181 -0.463 . . . . 75.24 110.953 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.692 ' CD1' HD12 ' A' ' 122' ' ' LEU . 5.0 pt -148.25 150.08 33.78 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.679 0.752 . . . . 71.34 111.161 179.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 24.51 0.18 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.658 2.239 . . . . 72.21 112.377 179.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.692 HD12 ' CD1' ' A' ' 120' ' ' ILE . 8.3 mt -70.95 -155.03 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.107 -0.497 . . . . 73.22 110.92 179.938 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.58 ' CD2' HG23 ' A' ' 88' ' ' VAL . 3.5 t-160 -172.53 121.51 0.42 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.136 -0.484 . . . . 74.12 110.871 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.9 m-85 -106.97 141.79 37.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.261 -0.427 . . . . 75.54 110.876 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.676 ' HB3' HG22 ' A' ' 90' ' ' THR . 0.0 OUTLIER -115.24 141.17 48.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.191 -0.459 . . . . 75.14 110.897 -179.931 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.88 140.09 35.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.153 -0.476 . . . . 72.22 110.864 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . 0.913 HG11 ' HB2' ' A' ' 132' ' ' ALA . 32.7 m -103.06 138.29 27.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.205 -0.452 . . . . 50.13 111.132 179.866 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.409 HG23 ' NE1' ' A' ' 129' ' ' TRP . 0.0 OUTLIER -153.47 -27.66 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.166 -0.47 . . . . 74.43 111.107 179.966 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' TRP . . . . . 0.409 ' NE1' HG23 ' A' ' 128' ' ' VAL . 0.0 OUTLIER -134.5 109.26 8.6 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.1 -0.5 . . . . 71.25 110.932 179.95 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 107.39 -160.5 14.05 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.737 -0.744 . . . . 62.11 112.538 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -101.83 155.64 18.01 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.829 0.347 . . . . 63.25 111.165 -179.883 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . 0.913 ' HB2' HG11 ' A' ' 127' ' ' VAL . . . -112.22 165.28 12.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.216 -0.447 . . . . 51.34 111.061 179.932 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -73.11 -57.03 4.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 75.41 110.834 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . 0.708 HG23 ' O ' ' A' ' 168' ' ' GLY . 7.0 mm -82.5 112.79 20.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.189 -0.459 . . . . 70.51 111.102 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 2.0 mmm -96.63 116.6 29.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.115 -0.493 . . . . 72.43 110.903 179.86 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.402 ' O ' HG23 ' A' ' 93' ' ' ILE . 0.8 OUTLIER -106.21 94.64 3.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.238 -0.437 . . . . 70.04 111.096 179.951 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . 0.458 ' HA3' ' HB ' ' A' ' 94' ' ' VAL . . . -134.31 169.46 23.02 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.748 -0.739 . . . . 63.34 112.514 179.856 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' PHE . . . . . 0.544 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 2.8 m-85 -105.13 149.83 25.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.847 0.356 . . . . 74.01 110.844 -179.864 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.544 ' HB2' ' O ' ' A' ' 138' ' ' PHE . . . 171.36 167.71 0.08 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.071 -0.513 . . . . 71.21 111.04 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.446 ' HB3' ' HB3' ' A' ' 149' ' ' PHE . 35.1 mtp180 -103.95 173.04 6.47 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.188 -0.46 . . . . 62.21 110.855 -179.883 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -57.34 -16.23 19.74 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.682 -0.77 . . . . 74.24 112.553 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -94.52 13.34 24.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.804 0.335 . . . . 75.03 111.075 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . 0.465 ' HB3' ' HB1' ' A' ' 139' ' ' ALA . 9.2 p80 -71.49 -9.35 58.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 71.11 110.854 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 116.9 50.03 0.41 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.739 -0.743 . . . . 45.51 112.458 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -162.56 170.7 18.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.851 0.358 . . . . 72.14 110.851 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -64.11 175.86 1.15 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.129 -0.487 . . . . 51.25 110.836 -179.719 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 147' ' ' TYR . . . . . . . . . . . . . 11.2 m-85 64.37 119.36 0.02 OUTLIER Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.634 0.731 . . . . 73.4 110.95 -179.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.69 151.76 69.55 Favored 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.702 2.268 . . . . 74.53 112.327 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 149' ' ' PHE . . . . . 0.446 ' HB3' ' HB3' ' A' ' 140' ' ' ARG . 8.2 p90 -53.44 -42.7 67.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 63.52 110.867 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 75.55 -22.03 0.28 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.187 -0.46 . . . . 63.11 110.888 179.994 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . 0.444 ' H ' ' C ' ' A' ' 149' ' ' PHE . . . 75.64 -156.11 47.63 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.766 -0.731 . . . . 71.41 112.486 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -69.7 142.45 48.22 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.717 2.278 . . . . 75.11 112.362 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . 0.443 ' O ' ' C ' ' A' ' 154' ' ' ASN . . . 104.52 -137.27 13.52 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.719 -0.753 . . . . 70.32 112.466 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 154' ' ' ASN . . . . . 0.443 ' C ' ' O ' ' A' ' 153' ' ' GLY . 9.7 p30 -35.03 144.38 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.981 0.419 . . . . 73.25 110.919 -179.923 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 155' ' ' THR . . . . . 0.48 HG23 ' HA2' ' A' ' 68' ' ' GLY . 0.2 OUTLIER 73.49 106.75 0.07 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.178 -0.465 . . . . 44.41 111.119 -179.999 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 156' ' ' LEU . . . . . 0.987 HD21 HG21 ' A' ' 186' ' ' ILE . 0.6 OUTLIER -87.87 -55.16 3.88 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.2 -0.455 . . . . 75.02 110.873 179.962 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . 0.573 ' O ' ' N ' ' A' ' 68' ' ' GLY . . . -163.68 148.24 10.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.203 -0.453 . . . . 71.42 111.162 179.764 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 23.8 p-80 -107.01 128.95 54.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.234 -0.439 . . . . 72.02 110.912 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -109.84 160.33 16.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.195 -0.457 . . . . 74.42 111.078 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 10.7 m-30 -106.59 141.66 37.52 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.231 -0.441 . . . . 75.31 110.919 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . 0.687 ' HB1' ' HD2' ' A' ' 162' ' ' PRO . . . -73.85 163.48 68.08 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.57 0.7 . . . . 61.04 111.064 179.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 162' ' ' PRO . . . . . 0.687 ' HD2' ' HB1' ' A' ' 161' ' ' ALA . 52.8 Cg_endo -69.82 76.15 1.19 Allowed 'Trans proline' 0 C--N 1.341 0.136 0 C-N-CA 122.704 2.269 . . . . 74.44 112.31 -179.943 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -127.46 100.6 0.55 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.725 -0.75 . . . . 61.41 112.445 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 1.3 p 60.21 176.83 0.09 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.856 0.36 . . . . 73.1 111.144 -179.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -52.29 -47.94 54.86 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.733 -0.746 . . . . 74.03 112.439 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.17 -19.67 55.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.884 0.373 . . . . 65.12 110.925 -179.893 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -84.71 168.88 44.15 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.768 -0.729 . . . . 43.43 112.482 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 168' ' ' GLY . . . . . 0.708 ' O ' HG23 ' A' ' 134' ' ' ILE . . . 74.6 16.79 80.0 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.711 -0.757 . . . . 74.31 112.453 -179.916 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -77.33 150.2 35.21 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.818 0.342 . . . . 63.41 110.896 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -112.67 129.97 56.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.215 -0.448 . . . . 74.21 111.079 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 171' ' ' HIS . . . . . 0.528 ' O ' ' HB1' ' A' ' 157' ' ' ALA . 28.6 m170 -131.3 132.32 44.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.229 -0.442 . . . . 72.53 110.883 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 51.4 m-85 -117.72 139.38 51.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.166 -0.47 . . . . 71.44 110.903 -179.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 59.0 t0 -71.35 98.86 1.85 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.164 -0.471 . . . . 74.11 110.88 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . 1.7 pp20? -57.7 -16.33 10.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.225 -0.443 . . . . 72.25 110.859 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 175' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -78.95 -16.35 57.07 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.161 -0.472 . . . . 73.32 110.84 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 -82.11 -176.06 5.96 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.259 -0.428 . . . . 63.2 110.973 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 177' ' ' ARG . . . . . 0.436 ' HG3' ' HA3' ' A' ' 185' ' ' GLY . 4.3 ptp180 -116.82 111.86 20.31 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.219 -0.446 . . . . 63.14 110.944 -179.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 178' ' ' TRP . . . . . . . . . . . . . 5.1 m95 -117.29 152.27 35.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.172 -0.467 . . . . 72.31 110.944 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 179' ' ' THR . . . . . 0.427 ' HA ' HD11 ' A' ' 100' ' ' LEU . 7.8 t 178.41 163.7 0.73 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.27 -0.423 . . . . 74.13 111.142 -179.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -120.55 -75.09 0.59 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.21 -0.45 . . . . 45.33 110.892 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -56.13 -20.18 26.91 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.721 -0.752 . . . . 62.41 112.486 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 182' ' ' SER . . . . . 0.447 ' O ' ' C ' ' A' ' 183' ' ' SER . 0.4 OUTLIER -90.9 -24.7 20.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.963 0.411 . . . . 64.5 110.935 -179.802 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 183' ' ' SER . . . . . 0.447 ' C ' ' O ' ' A' ' 182' ' ' SER . 12.9 p 34.45 47.96 0.25 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.06 -0.518 . . . . 64.12 110.873 -179.806 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 3.6 tp -105.42 -33.71 8.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.102 -0.499 . . . . 74.2 110.981 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 185' ' ' GLY . . . . . 0.436 ' HA3' ' HG3' ' A' ' 177' ' ' ARG . . . -114.39 -141.82 7.79 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.763 -0.732 . . . . 73.01 112.504 179.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 186' ' ' ILE . . . . . 0.987 HG21 HD21 ' A' ' 156' ' ' LEU . 10.5 mm -78.82 97.58 2.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.888 0.375 . . . . 73.22 111.134 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -46.57 119.5 2.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.168 -0.469 . . . . 71.31 110.838 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 188' ' ' PHE . . . . . 0.746 ' CZ ' HG13 ' A' ' 105' ' ' VAL . 2.4 t80 -54.19 -36.46 63.45 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.474 . . . . 75.45 110.898 179.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . 0.456 HD21 ' CG ' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -67.11 -47.47 71.04 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.137 -0.483 . . . . 52.02 110.925 -179.965 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 58.3 t80 -69.07 -37.04 78.29 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.201 -0.454 . . . . 74.22 110.973 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 191' ' ' ALA . . . . . 0.579 ' HB2' HG22 ' A' ' 186' ' ' ILE . . . -72.81 -35.57 67.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.085 -0.507 . . . . 50.03 111.126 179.884 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 192' ' ' ALA . . . . . 0.679 ' O ' HD23 ' A' ' 196' ' ' LEU . . . -56.73 -44.84 82.06 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.217 -0.447 . . . . 52.11 111.131 179.847 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 193' ' ' THR . . . . . 0.551 HG21 ' HE1' ' A' ' 224' ' ' PHE . 0.7 OUTLIER -58.65 -41.89 87.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.168 -0.469 . . . . 72.43 111.161 -179.892 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 194' ' ' HIS . . . . . . . . . . . . . 2.6 t60 -72.83 -40.61 65.61 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.236 -0.438 . . . . 71.44 110.8 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 195' ' ' ALA . . . . . . . . . . . . . . . -73.42 -47.44 41.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.181 -0.463 . . . . 71.01 111.061 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 196' ' ' LEU . . . . . 0.743 HD12 ' CD1' ' A' ' 113' ' ' LEU . 4.4 mm? -64.2 -43.42 95.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.211 -0.45 . . . . 74.51 110.942 -179.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -57.44 -28.2 59.12 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.706 -0.759 . . . . 52.23 112.473 179.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 198' ' ' HIS . . . . . . . . . . . . . 4.7 m-70 -66.5 -44.26 83.07 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.827 0.346 . . . . 75.21 110.871 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.42 -25.86 64.69 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.207 -0.451 . . . . 71.13 110.891 -179.824 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 1.5 mt -82.22 -3.07 54.33 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.161 -0.472 . . . . 64.13 110.879 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 88.96 -5.64 84.36 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.807 -0.711 . . . . 50.41 112.565 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 202' ' ' MET . . . . . 0.438 ' SD ' HD12 ' A' ' 234' ' ' ILE . 2.2 mtp -61.93 134.97 57.34 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.815 0.34 . . . . 63.21 110.907 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 203' ' ' GLY . . . . . . . . . . . . . . . -101.17 177.11 27.32 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.787 -0.721 . . . . 64.44 112.494 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 17.9 m-70 -70.26 160.76 31.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.782 0.325 . . . . 74.32 110.868 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 205' ' ' SER . . . . . 0.476 ' OG ' ' HB1' ' A' ' 210' ' ' ALA . 0.0 OUTLIER -121.39 151.72 39.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.194 -0.457 . . . . 53.34 110.827 -179.768 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 2.0 p -87.73 -4.63 58.89 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.178 -0.465 . . . . 72.22 110.818 -179.834 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.83 137.9 82.63 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.646 0.736 . . . . 65.11 110.791 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 208' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 -7.61 21.49 Favored 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.641 2.227 . . . . 74.53 112.311 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -126.08 29.79 5.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.26 -0.427 . . . . 63.52 110.862 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 210' ' ' ALA . . . . . 0.476 ' HB1' ' OG ' ' A' ' 205' ' ' SER . . . -87.34 145.76 26.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.123 -0.489 . . . . 62.23 111.112 179.878 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -69.69 -28.57 37.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.185 -0.461 . . . . 62.04 111.08 -179.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 212' ' ' MET . . . . . . . . . . . . . 14.0 tpp -96.48 10.49 38.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.177 -0.465 . . . . 75.22 110.953 179.884 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 213' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -55.69 115.05 8.5 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.629 0.728 . . . . 73.43 110.862 -179.791 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.78 -18.11 37.12 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.661 2.24 . . . . 63.01 112.353 179.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 215' ' ' THR . . . . . 0.477 HG23 ' CG2' ' A' ' 61' ' ' ILE . 0.3 OUTLIER -84.2 52.95 2.46 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.254 -0.43 . . . . 74.24 111.165 -179.991 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 216' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -74.75 124.81 27.47 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.163 -0.471 . . . . 74.14 110.912 -179.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . 163.08 103.03 0.17 Allowed Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.801 -0.714 . . . . 74.22 112.51 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 218' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -179.55 -73.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.888 0.375 . . . . 64.22 110.911 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . -142.36 -179.4 19.22 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.791 -0.719 . . . . 72.24 112.514 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 220' ' ' ASP . . . . . . . . . . . . . 54.7 m-20 -89.53 146.66 36.22 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.59 0.709 . . . . 41.43 110.848 -179.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 221' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.8 114.08 3.59 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.643 2.229 . . . . 73.42 112.331 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.62 -45.42 15.83 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.235 -0.438 . . . . 74.21 110.891 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 223' ' ' ASN . . . . . . . . . . . . . 8.8 m-20 -130.43 -40.12 1.28 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.224 -0.443 . . . . 60.33 110.921 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 224' ' ' PHE . . . . . 0.551 ' HE1' HG21 ' A' ' 193' ' ' THR . 0.0 OUTLIER 65.67 127.24 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.139 -0.482 . . . . 65.01 110.895 179.973 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 225' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -143.76 161.0 39.73 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.166 -0.47 . . . . 64.24 110.907 179.941 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . 0.768 HD11 ' O ' ' A' ' 115' ' ' MET . 36.3 mt -64.38 147.99 51.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.272 -0.422 . . . . 53.44 110.849 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 227' ' ' SER . . . . . 0.463 ' CB ' ' HA ' ' A' ' 210' ' ' ALA . 0.9 OUTLIER -87.73 150.86 23.34 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.106 -0.497 . . . . 74.21 110.832 -179.924 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 228' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 -65.08 -66.8 0.5 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.18 -0.464 . . . . 74.54 110.922 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -55.37 -26.02 38.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.208 -0.451 . . . . 72.22 110.902 179.932 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -70.37 -49.04 53.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.156 -0.474 . . . . 74.23 110.868 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 231' ' ' ILE . . . . . 0.679 HD11 ' HB3' ' A' ' 226' ' ' LEU . 9.4 mt -69.4 -44.18 80.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.263 -0.426 . . . . 73.41 111.12 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 232' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.8 -31.98 65.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.142 -0.481 . . . . 65.42 110.932 179.86 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . -70.13 -46.05 52.91 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.72 -0.753 . . . . 63.43 112.48 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 234' ' ' ILE . . . . . 0.438 HD12 ' SD ' ' A' ' 202' ' ' MET . 15.1 tt -73.18 -32.94 40.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.784 0.326 . . . . 71.54 111.114 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -66.33 -24.35 66.51 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.147 -0.479 . . . . 70.33 110.954 179.904 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 236' ' ' LYS . . . . . 0.46 ' HD3' ' N ' ' A' ' 237' ' ' LEU . 0.0 OUTLIER -74.04 -28.97 61.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.172 -0.467 . . . . 51.21 110.829 -179.983 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 237' ' ' LEU . . . . . 0.738 HD22 ' CD ' ' A' ' 83' ' ' LYS . 5.7 tt -97.09 -23.61 16.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.251 -0.431 . . . . 75.41 110.925 179.952 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 238' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -92.45 -35.53 13.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.17 -0.468 . . . . 51.24 110.927 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 239' ' ' GLY . . . . . . . . . . . . . . . -157.48 -116.31 0.49 Allowed Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.724 -0.75 . . . . 32.22 112.451 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 6.7 tttm -100.2 129.82 46.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.803 0.335 . . . . 75.42 110.894 -179.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 241' ' ' ARG . . . . . . . . . . . . . 5.6 ptm180 -59.42 175.76 0.31 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.289 -0.414 . . . . 73.34 110.842 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 242' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -129.75 -177.91 4.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.23 -0.441 . . . . 62.42 110.909 -179.845 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 243' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -126.75 121.81 33.07 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.199 -0.455 . . . . 72.13 110.918 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 30.9 t -174.79 164.3 3.52 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.153 -0.476 . . . . 62.23 110.883 -179.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 245' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -172.0 163.01 6.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.125 -0.489 . . . . 70.43 110.921 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 246' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -175.57 38.24 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.202 -0.454 . . . . 72.11 110.87 179.954 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 247' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.16 -0.473 . . . . 74.13 110.937 179.874 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 302' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 303' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 304' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_